In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 2nd, 2008 | 18 | Yes |
Popular Name: 2-[(5-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-phenyl-propanamide 2-[(5-methyl-4H-1,2,4-triazol-3-…
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) | 1.56 | 5.56 | -9.84 | 2 | 5 | 0 | 71 | 262.338 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.56 | 5.38 | -13.5 | 2 | 5 | 0 | 71 | 262.338 | 4 | ↓ |