In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2010 | 15 | No |
Popular Name: 4-[(1R,2R)-2-methylcyclopropyl]-5-(2-thienyl)-1,2,4-triazole-3-thiol 4-[(1R,2R)-2-methylcyclopropyl]-…
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) | 3.05 | 7.74 | -46.17 | 0 | 3 | -1 | 31 | 236.345 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.32 | 7.53 | -8.64 | 1 | 3 | 0 | 34 | 237.353 | 2 | ↓ |