In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 6th, 2010 | 29 | No |
Popular Name: N-(2-naphthyl)-2-[[5-(3-nitrophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl]acetamide N-(2-naphthyl)-2-[[5-(3-nitrophe…
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) | 4.35 | 10.76 | -17.31 | 2 | 8 | 0 | 116 | 405.439 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.35 | 10.56 | -46.23 | 1 | 8 | -1 | 115 | 404.431 | 6 | ↓ |