In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 11th, 2006 | 23 | Yes |
Popular Name: ({[(3-cyano-6-ethyl-5,6,7,8-tetrahydro-2-quinolinyl)sulfanyl]acetyl}amino)acetic acid ({[(3-cyano-6-ethyl-5,6,7,8-tetr…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 0.91 | -1 | -47.06 | 1 | 6 | -1 | 105 | 332.405 | 6 | ↓ |
Lo Low (pH 4.5-6) | 0.91 | -0.89 | -62.72 | 2 | 6 | 0 | 107 | 333.413 | 6 | ↓ |