In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 7th, 2008 | 33 | Yes |
Popular Name: (2S)-2-[[4-benzyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(4-ethoxyphenyl)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) | 4.62 | 12.11 | -15.46 | 1 | 7 | 0 | 82 | 459.575 | 9 | ↓ |