In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 4th, 2009 | 19 | Yes |
Popular Name: N-(3-cyanophenyl)-2-[(5-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide N-(3-cyanophenyl)-2-[(5-methyl-4…
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) | 0.93 | 5.13 | -25.38 | 2 | 6 | 0 | 94 | 273.321 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.93 | 4.99 | -48.54 | 1 | 6 | -1 | 93 | 272.313 | 4 | ↓ |