In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 6th, 2010 | 29 | Yes |
Popular Name: 2-[(4-allyl-5-benzyl-1,2,4-triazol-3-yl)sulfanyl]-1-[(2S)-2-methylindolin-1-yl]ethanone 2-[(4-allyl-5-benzyl-1,2,4-triaz…
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) | 4.46 | 14.3 | -12.57 | 0 | 5 | 0 | 51 | 404.539 | 7 | ↓ |