In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 7th, 2010 | 27 | No |
Popular Name: N-(2-methoxyphenyl)-2-[[5-(3-nitrophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl]acetamide N-(2-methoxyphenyl)-2-[[5-(3-nit…
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) | 3.17 | 7.91 | -15.54 | 2 | 9 | 0 | 126 | 385.405 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.17 | 7.71 | -46.43 | 1 | 9 | -1 | 124 | 384.397 | 7 | ↓ |