Relationship Network
Interactive first-hop connections across herbs, ingredients, formulas, targets, diseases, symptoms, syndromes, evidence, and monographs.
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Herb: 1Ingredient: 1Target: 7Links: 8
Arranging relationship network...
Record Fields
Scalar fields from the final ingredient record.
- Ingredient Id
- 67426
- Core Entity Id
- 130075
- Source Entity Count
- 1
- Preferred Name
- 2'-deoxythymidine
- Name En
- Pubchem Id
- 5789
- Smiles Canonical
- CC1=CN(C(=O)NC1=O)C2CC(C(O2)CO)O
- Molecular Formula
- C10H14N2O5
- Molecular Weight
- 242.0900
- Inchikey
- IQFYYKKMVGJFEH-XLPZGREQSA-N
- Inchi
- InChI=1S/C10H14N2O5/c1-5-3-12(10(16)11-9(5)15)8-2-6(14)7(4-13)17-8/h3,6-8,13-14H,2,4H2,1H3,(H,11,15,16)/t6-,7+,8+/m0/s1
- Isomeric Smiles
- Cas Id
- Ob Score
- Mol Logp
- -1.2000
- Num H Donors
- 3
- Num H Acceptors
- 5
- Num Rotatable Bonds
- 2
- Drug Likeness
- Polar Surface Area
- 99.1000
- Molecular Volume
- Alogp
Names
Preferred names, aliases, and source labels retained in the final schema.
Name
2'-deoxythymidine
Role
preferred
Source
ETCM_v2
Preferred
Yes
Cross References
Trusted external identifiers retained for this final record.
Etcm Ingredient
2'-deoxythymidine
Itcmdb Generated
ITX-INGREDIENT-B83960CDDEA7
Attributes
Merged source attributes and domain-specific metadata.
Molecular Weight
242.090
Molecular Formula
C10H14N2O5
Fda Maximum Daily Dose (Fdamdd)
0.041
Quantitative Estimate Of Drug Likeness（Qed）
0.584