Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 12Ingredient: 1Meta-analysis: 12Target: 12Links: 36
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 36175
- Core Entity Id
- 43401
- Source Entity Count
- 1
- Preferred Name
- Ur
- Name En
- Pubchem Id
- 1176
- Smiles Canonical
- C(=O)(N)N
- Molecular Formula
- CH4N2O
- Molecular Weight
- 60.0560
- Inchikey
- XSQUKJJJFZCRTK-UHFFFAOYSA-N
- Inchi
- InChI=1S/CH4N2O/c2-1(3)4/h(H4,2,3,4)
- Isomeric Smiles
- C(=O)(N)N
- Cas Id
- 4744-36-9
- Ob Score
- 26.4560
- Mol Logp
- -0.9762
- Num H Donors
- 2
- Num H Acceptors
- 1
- Num Rotatable Bonds
- 0
- Drug Likeness
- 0.3710
- Polar Surface Area
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
Ur
Role
Molecule_name
Source
SymMap_v2
Preferred
Yes
Name
Ur
Role
preferred
Source
itcmdb_public
Preferred
Yes
Name
Ur
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
Ur
Role
preferred
Source
SymMap_v2
Preferred
Yes
Name
Urea
Role
preferred
Source
HERB_v2
Preferred
Yes
Name
Urea
Role
preferred
Source
ETCM_v2
Preferred
Yes
Name
Urea
Role
preferred
Source
itcmdb_public
Preferred
Yes
Name
Urea
Role
preferred
Source
SymMap_v2
Preferred
Yes
Name
urea
Role
preferred
Source
TCMBank
Preferred
Yes
Name
1-(3-benzylphenyl)-3-[4-[(3-methoxy-1-naphthyl)amino]pentyl]urea
Role
alias
Source
TCMBank
Preferred
No
Name
1-Benzhydryl-3-[4-(methoxy-quinolin-8-ylamino)-pentyl]-urea
Role
alias
Source
TCMBank
Preferred
No
Name
173144-80-4
Role
alias
Source
TCMBank
Preferred
No
Name
173994-65-5
Role
alias
Source
TCMBank
Preferred
No
Name
174693-33-5
Role
alias
Source
TCMBank
Preferred
No
Name
175276-38-7
Role
alias
Source
TCMBank
Preferred
No
Name
299367_ALDRICH
Role
alias
Source
TCMBank
Preferred
No
Name
30535-50-3
Role
alias
Source
TCMBank
Preferred
No
Name
33247_RIEDEL
Role
alias
Source
TCMBank
Preferred
No
Name
37955-36-5
Role
alias
Source
TCMBank
Preferred
No
Name
4744-36-9
Role
alias
Source
TCMBank
Preferred
No
Name
51456_FLUKA
Role
alias
Source
TCMBank
Preferred
No
Name
51457_FLUKA
Role
alias
Source
TCMBank
Preferred
No
Name
51459_FLUKA
Role
alias
Source
TCMBank
Preferred
No
Name
51460_FLUKA
Role
alias
Source
TCMBank
Preferred
No
Name
51465_FLUKA
Role
alias
Source
TCMBank
Preferred
No
Name
57-13-6
Role
alias
Source
HERB_v2
Preferred
No
Name
57-13-6
Role
alias
Source
TCMBank
Preferred
No
Name
57-13-6
Role
alias
Source
itcmdb_public
Preferred
No
Name
AI3-01202
Role
alias
Source
TCMBank
Preferred
No
Name
AIDS-003652
Role
alias
Source
TCMBank
Preferred
No
Name
ARF
Role
alias
Source
TCMBank
Preferred
No
Name
Alphadrate
Role
alias
Source
TCMBank
Preferred
No
Name
Aqua Care
Role
alias
Source
TCMBank
Preferred
No
Name
Aquacare HP
Role
alias
Source
TCMBank
Preferred
No
Name
Aquadrate
Role
alias
Source
TCMBank
Preferred
No
Name
B-I-K
Role
alias
Source
TCMBank
Preferred
No
Name
BSPBio_003341
Role
alias
Source
TCMBank
Preferred
No
Name
Benural 70
Role
alias
Source
TCMBank
Preferred
No
Name
C00086
Role
alias
Source
TCMBank
Preferred
No
Name
CCRIS 989
Role
alias
Source
TCMBank
Preferred
No
Name
CHEBI:16199
Role
alias
Source
TCMBank
Preferred
No
Name
Carbaderm
Role
alias
Source
TCMBank
Preferred
No
Name
Carbamide resin
Role
alias
Source
TCMBank
Preferred
No
Name
Carbamimic acid
Role
alias
Source
TCMBank
Preferred
No
Name
Carbamimidic acid
Role
alias
Source
HERB_v2
Preferred
No
Name
Carbamimidic acid
Role
alias
Source
itcmdb_public
Preferred
No
Name
Carbamimidic acid
Role
alias
Source
TCMBank
Preferred
No
Name
Carbamimidic acid (VAN)
Role
alias
Source
TCMBank
Preferred
No
Name
Carbonyldiamide
Role
alias
Source
itcmdb_public
Preferred
No
Name
Carbonyldiamide
Role
alias
Source
TCMBank
Preferred
No
Name
Carbonyldiamide
Role
alias
Source
HERB_v2
Preferred
No
Name
Carbonyldiamine
Role
alias
Source
itcmdb_public
Preferred
No
Name
Carbonyldiamine
Role
alias
Source
HERB_v2
Preferred
No
Name
Carbonyldiamine
Role
alias
Source
TCMBank
Preferred
No
Name
Carmol 40
Role
alias
Source
TCMBank
Preferred
No
Name
Caswell No. 902
Role
alias
Source
TCMBank
Preferred
No
Name
D00023
Role
alias
Source
TCMBank
Preferred
No
Name
DivK1c_000086
Role
alias
Source
TCMBank
Preferred
No
Name
EINECS 200-315-5
Role
alias
Source
TCMBank
Preferred
No
Name
EPA Pesticide Chemical Code 085702
Role
alias
Source
TCMBank
Preferred
No
Name
Elaqua XX
Role
alias
Source
TCMBank
Preferred
No
Name
Eucerin 10% Urea Lotion
Role
alias
Source
TCMBank
Preferred
No
Name
H2NC(O)NH2
Role
alias
Source
TCMBank
Preferred
No
Name
HSDB 163
Role
alias
Source
TCMBank
Preferred
No
Name
Harnstoff
Role
alias
Source
TCMBank
Preferred
No
Name
Harnstoff [German]
Role
alias
Source
TCMBank
Preferred
No
Name
Hyanit
Role
alias
Source
TCMBank
Preferred
No
Name
IDI1_000086
Role
alias
Source
TCMBank
Preferred
No
Name
InChI=1/CH4N2O/c2-1(3)4/h(H4,2,3,4
Role
alias
Source
TCMBank
Preferred
No
Name
Isourea
Role
alias
Source
itcmdb_public
Preferred
No
Name
Isourea
Role
alias
Source
HERB_v2
Preferred
No
Name
Isourea
Role
alias
Source
TCMBank
Preferred
No
Name
KBio1_000086
Role
alias
Source
TCMBank
Preferred
No
Name
KBio2_001152
Role
alias
Source
TCMBank
Preferred
No
Name
KBio2_003720
Role
alias
Source
TCMBank
Preferred
No
Name
KBio2_006288
Role
alias
Source
TCMBank
Preferred
No
Name
KBio3_002843
Role
alias
Source
TCMBank
Preferred
No
Name
KBioGR_001775
Role
alias
Source
TCMBank
Preferred
No
Name
KBioSS_001152
Role
alias
Source
TCMBank
Preferred
No
Name
Karbamid
Role
alias
Source
TCMBank
Preferred
No
Name
Keratinamin
Role
alias
Source
TCMBank
Preferred
No
Name
Keratinamin Kowa
Role
alias
Source
TCMBank
Preferred
No
Name
Mocovina [Czech]
Role
alias
Source
TCMBank
Preferred
No
Name
NCGC00090892-01
Role
alias
Source
TCMBank
Preferred
No
Name
NCGC00090892-02
Role
alias
Source
TCMBank
Preferred
No
Name
NCGC00090892-03
Role
alias
Source
TCMBank
Preferred
No
Name
NCI-C02119
Role
alias
Source
TCMBank
Preferred
No
Name
NINDS_000086
Role
alias
Source
TCMBank
Preferred
No
Name
NSC 34375
Role
alias
Source
TCMBank
Preferred
No
Name
Optigen 1200
Role
alias
Source
TCMBank
Preferred
No
Name
Panafil
Role
alias
Source
TCMBank
Preferred
No
Name
Pastaron
Role
alias
Source
TCMBank
Preferred
No
Name
Pastaron (TN)
Role
alias
Source
TCMBank
Preferred
No
Name
Pastaron 10
Role
alias
Source
TCMBank
Preferred
No
Name
Pastaron 20
Role
alias
Source
TCMBank
Preferred
No
Name
Pastaron 20 soft
Role
alias
Source
TCMBank
Preferred
No
Name
Pastaron soft
Role
alias
Source
TCMBank
Preferred
No
Name
Polyurea
Role
alias
Source
TCMBank
Preferred
No
Name
Prespersion, 75 urea
Role
alias
Source
TCMBank
Preferred
No
Name
Pseudourea
Role
alias
Source
TCMBank
Preferred
No
Name
Rubinol ST 010
Role
alias
Source
TCMBank
Preferred
No
Name
SPBio_001263
Role
alias
Source
TCMBank
Preferred
No
Name
SPECTRUM1500604
Role
alias
Source
TCMBank
Preferred
No
Name
ST5214565
Role
alias
Source
TCMBank
Preferred
No
Name
Spectrum2_001192
Role
alias
Source
TCMBank
Preferred
No
Name
Spectrum3_001791
Role
alias
Source
TCMBank
Preferred
No
Name
Spectrum4_001168
Role
alias
Source
TCMBank
Preferred
No
Name
Spectrum5_001862
Role
alias
Source
TCMBank
Preferred
No
Name
Spectrum_000672
Role
alias
Source
TCMBank
Preferred
No
Name
Supercel 3000
Role
alias
Source
TCMBank
Preferred
No
Name
U0631_SIGMA
Role
alias
Source
TCMBank
Preferred
No
Name
U1250_SIGMA
Role
alias
Source
TCMBank
Preferred
No
Name
U4128_SIGMA
Role
alias
Source
TCMBank
Preferred
No
Name
U4883_SIGMA
Role
alias
Source
TCMBank
Preferred
No
Name
U4884_SIGMA
Role
alias
Source
TCMBank
Preferred
No
Name
U5128_SIAL
Role
alias
Source
TCMBank
Preferred
No
Name
U5378_SIGMA
Role
alias
Source
TCMBank
Preferred
No
Name
U6504_SIGMA
Role
alias
Source
TCMBank
Preferred
No
Name
U7129_SIGMA
Role
alias
Source
TCMBank
Preferred
No
Name
UR
Role
alias
Source
TCMBank
Preferred
No
Name
URE
Role
alias
Source
TCMBank
Preferred
No
Name
UREA
Role
alias
Source
TCMBank
Preferred
No
Name
Ultra Mide
Role
alias
Source
TCMBank
Preferred
No
Name
Urea (8CI,9CI)
Role
alias
Source
TCMBank
Preferred
No
Name
Urea (JP15/USP)
Role
alias
Source
TCMBank
Preferred
No
Name
Urea [JAN]
Role
alias
Source
TCMBank
Preferred
No
Name
Urea ammonium nitrate solution
Role
alias
Source
TCMBank
Preferred
No
Name
Urea perhydrate
Role
alias
Source
TCMBank
Preferred
No
Name
Urea solution
Role
alias
Source
TCMBank
Preferred
No
Name
Urea, homopolymer
Role
alias
Source
TCMBank
Preferred
No
Name
Urea-12C
Role
alias
Source
TCMBank
Preferred
No
Name
Urea-13C
Role
alias
Source
TCMBank
Preferred
No
Name
Ureacin-10 lotion
Role
alias
Source
TCMBank
Preferred
No
Name
Ureacin-20
Role
alias
Source
TCMBank
Preferred
No
Name
Ureacin-40 Creme
Role
alias
Source
TCMBank
Preferred
No
Name
Ureaphil
Role
alias
Source
TCMBank
Preferred
No
Name
Ureaphil
Role
alias
Source
itcmdb_public
Preferred
No
Name
Ureaphil
Role
alias
Source
HERB_v2
Preferred
No
Name
Ureophil
Role
alias
Source
TCMBank
Preferred
No
Name
Ureophil
Role
alias
Source
HERB_v2
Preferred
No
Name
Ureophil
Role
alias
Source
itcmdb_public
Preferred
No
Name
Urepeal
Role
alias
Source
TCMBank
Preferred
No
Name
Urepeal L
Role
alias
Source
TCMBank
Preferred
No
Name
Urepearl
Role
alias
Source
TCMBank
Preferred
No
Name
Urevert
Role
alias
Source
TCMBank
Preferred
No
Name
Urevert
Role
alias
Source
itcmdb_public
Preferred
No
Name
Urevert
Role
alias
Source
HERB_v2
Preferred
No
Name
Varioform II
Role
alias
Source
TCMBank
Preferred
No
Name
WLN: ZVZ
Role
alias
Source
TCMBank
Preferred
No
Name
c0165
Role
alias
Source
TCMBank
Preferred
No
Name
carbamide
Role
alias
Source
TCMBank
Preferred
No
Name
carbamide
Role
alias
Source
HERB_v2
Preferred
No
Name
carbamide
Role
alias
Source
itcmdb_public
Preferred
No
Name
carmol
Role
alias
Source
TCMBank
Preferred
No
Name
component of Artra Ashy Skin Cream
Role
alias
Source
TCMBank
Preferred
No
Name
urea
Role
alias
Source
HERB_v2
Preferred
No
Name
urea
Role
alias
Source
itcmdb_public
Preferred
No
Name
uree
Role
alias
Source
TCMBank
Preferred
No
Aliases
Additional names normalized into the restored final schema.
Urea1-(3-benzylphenyl)-3-[4-[(3-methoxy-1-naphthyl)amino]pentyl]urea1-Benzhydryl-3-[4-(methoxy-quinolin-8-ylamino)-pentyl]-urea173144-80-4173994-65-5174693-33-5175276-38-7299367_ALDRICH30535-50-333247_RIEDEL37955-36-54744-36-951456_FLUKA51457_FLUKA51459_FLUKA51460_FLUKA51465_FLUKA57-13-6AI3-01202AIDS-003652ARFAlphadrateAqua CareAquacare HPAquadrateB-I-KBSPBio_003341Benural 70C00086CCRIS 989CHEBI:16199CarbadermCarbamide resinCarbamimic acidCarbamimidic acidCarbamimidic acid (VAN)CarbonyldiamideCarbonyldiamineCarmol 40Caswell No. 902D00023DivK1c_000086EINECS 200-315-5EPA Pesticide Chemical Code 085702Elaqua XXEucerin 10% Urea LotionH2NC(O)NH2HSDB 163HarnstoffHarnstoff [German]HyanitIDI1_000086InChI=1/CH4N2O/c2-1(3)4/h(H4,2,3,4IsoureaKBio1_000086KBio2_001152KBio2_003720KBio2_006288KBio3_002843KBioGR_001775KBioSS_001152KarbamidKeratinaminKeratinamin KowaMocovina [Czech]NCGC00090892-01NCGC00090892-02NCGC00090892-03NCI-C02119NINDS_000086NSC 34375Optigen 1200PanafilPastaronPastaron (TN)Pastaron 10Pastaron 20Pastaron 20 softPastaron softPolyureaPrespersion, 75 ureaPseudoureaRubinol ST 010SPBio_001263SPECTRUM1500604ST5214565Spectrum2_001192Spectrum3_001791Spectrum4_001168Spectrum5_001862Spectrum_000672Supercel 3000U0631_SIGMAU1250_SIGMAU4128_SIGMAU4883_SIGMAU4884_SIGMAU5128_SIALU5378_SIGMAU6504_SIGMAU7129_SIGMAUREUltra MideUrea (8CI,9CI)Urea (JP15/USP)Urea [JAN]Urea ammonium nitrate solutionUrea perhydrateUrea solutionUrea, homopolymerUrea-12CUrea-13CUreacin-10 lotionUreacin-20Ureacin-40 CremeUreaphilUreophilUrepealUrepeal LUrepearlUrevertVarioform IIWLN: ZVZc0165carbamidecarmolcomponent of Artra Ashy Skin Creamuree
Cross References
Trusted external identifiers retained for this final record.
Cas
4744-36-9
Hit
C0470
Herb
HBIN047559HBIN047573
Npass
NPC142330NPC84279
Tcmid
22230
Tcmsp
MOL013046
Sym Map
SMIT13750SMIT18140
Pub Chem
1176
Tcmbank
TCMBANKIN057918
Drug Bank
DB03904
Etcm Ingredient
Urea
Itcmdb Generated
ITX-INGREDIENT-5E78BD3DAB72ITX-INGREDIENT-70D6D8A04744
Attributes
Merged source attributes and domain-specific metadata.
Type
Other ingredients
In Ch I
InChI=1S/CH4N2O/c2-1(3)4/h(H4,2,3,4)
Mol Wt
60.05599999999999
Cas Id
4744-36-9
Smiles
C(=O)(N)N
Mol Log P
-0.9762
Version
v1,v2
In Ch Ikey
XSQUKJJJFZCRTK-UHFFFAOYSA-N
Ob Score
26.45626.45635426.45635442
Suppress
0
Num Hdonors
2
Drug Likeness
0.371
Num Hacceptors
1
Isomeric Smiles
C(=O)(N)N
Molecule Weight
60.07
Canonical Smiles
C(=O)(N)N
Herb Alias Names
urea57-13-6carbamideIsoureaCarbonyldiamideUreophilCarbonyldiamineUreaphilCarbamimidic acidUrevert
Molecular Weight
60.030
Molecular Weight
60.056 g/mol; 60.06
Molecular Formula
CH4N2O
Molecular Formula
CH4N2O
Molecular Formula
CH4N2O
Num Rotatable Bonds
0
Fda Maximum Daily Dose (Fdamdd)
0.018
Quantitative Estimate Of Drug Likeness（Qed）
0.371