Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
Click a node to open it in a new tab
Ingredient: 1Target: 7Links: 14
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 69519
- Core Entity Id
- 132168
- Source Entity Count
- 1
- Preferred Name
- 8-bromo-cAMP
- Name En
- Pubchem Id
- 32014
- Smiles Canonical
- C1C2C(C(C(O2)N3C4=NC=NC(=C4N=C3Br)N)O)OP(=O)(O1)O
- Molecular Formula
- C10H10BrN5O6P-
- Molecular Weight
- 405.9600
- Inchikey
- DVKQVRZMKBDMDH-UUOKFMHZSA-N
- Inchi
- InChI=1S/C10H11BrN5O6P/c11-10-15-4-7(12)13-2-14-8(4)16(10)9-5(17)6-3(21-9)1-20-23(18,19)22-6/h2-3,5-6,9,17H,1H2,(H,18,19)(H2,12,13,14)/t3-,5-,6-,9-/m1/s1
- Isomeric Smiles
- Cas Id
- Ob Score
- Mol Logp
- -1.5000
- Num H Donors
- 3
- Num H Acceptors
- 10
- Num Rotatable Bonds
- 1
- Drug Likeness
- Polar Surface Area
- 155.0000
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
8-bromo-cAMP
Role
preferred
Source
ETCM_v2
Preferred
Yes
Cross References
Trusted external identifiers retained for this final record.
Etcm Ingredient
8-bromo-cAMP
Itcmdb Generated
ITX-INGREDIENT-C93B821819B4
Attributes
Merged source attributes and domain-specific metadata.
Molecular Weight
405.960
Molecular Formula
C10H10BrN5O6P-
Fda Maximum Daily Dose (Fdamdd)
0.802
Quantitative Estimate Of Drug Likeness（Qed）
0.439