In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2010 | 11 | No |
Popular Name: 5-methyl-4-[(1R,2R)-2-methylcyclopropyl]-1,2,4-triazole-3-thiol 5-methyl-4-[(1R,2R)-2-methylcycl…
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) | 0.51 | 5.68 | -11.15 | 1 | 3 | 0 | 34 | 169.253 | 1 | ↓ |
Mid Mid (pH 6-8) | 1.24 | 5.82 | -45.96 | 0 | 3 | -1 | 31 | 168.245 | 1 | ↓ |