In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 4th, 2009 | 34 | Yes |
Popular Name: (2S)-2-[[4-benzyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(5-quinolyl)propanamide (2S)-2-[[4-benzyl-5-(3-pyridyl)-…
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) | 4.44 | 12.43 | -15.82 | 1 | 7 | 0 | 86 | 466.57 | 7 | ↓ |