Drug ID:   | NPD8197 |
Drug Name:   | L-cycloserine |
Molecular Formula:   | C3H6N2O2 |
Canonical SMILES:   | N[C@H]1CON=C1O |
Standard InCHI:   | InChI=1S/C3H6N2O2/c4-2-1-7-5-3(2)6/h2H,1,4H2,(H,5,6)/t2-/m0/s1 |
Standard InCHIKey:   | DYDCUQKUCUHJBH-REOHCLBHSA-N |
Max Developmental Stage:   | Approved |
Max Developmental Stage Source:   | IUPHAR/BPS |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules. Tc lies between [0, 1] where '1' indicates the highest similarity. What is Tanimoto coefficient
Tanimoto coefficient is calculated based on PubChem 881-bit substructure fingerprints.
High Similarity Level: Tc>=0.85; Intermediate Similarity Level: 0.7 <= Tc < 0.85; Remote Similarity Level: 0.65 <= Tc < 0.7
Similarity Level | Similarity Score | Natural Product ID |
---|---|---|
High Similarity | 1.0 | NPC105488 |
Remote Similarity | 0.6341 | NPC84444 |
Remote Similarity | 0.6341 | NPC145217 |
Remote Similarity | 0.623 | NPC118524 |
Remote Similarity | 0.6226 | NPC329495 |
Remote Similarity | 0.6 | NPC297220 |
Remote Similarity | 0.6 | NPC470666 |
Remote Similarity | 0.5833 | NPC219143 |
Remote Similarity | 0.5833 | NPC226265 |
Remote Similarity | 0.5769 | NPC153370 |
Remote Similarity | 0.5652 | NPC25237 |
Remote Similarity | 0.5641 | NPC262962 |
TTD   | |
DrugBank   | |
ChEMBL   | |
IUPHAR/BPS   | 9488 |
PharmaGKB   | |
KEGG Drug   | |
PubChem CID   | |
ChEBI   | |
CAS Number   |
Molecular Weight   | 102.04 |
ALogP   | -1.1311 |
MLogP   | 1.35 |
XLogP   | -0.024 |
HDA   | 2 |
HBD   | 2 |
Rotatable Bonds   | 2 |
TPSA   | 67.84 |
RO5 Violation   | 0 |