In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 19th, 2010 | 15 | No |
Popular Name: 5-cyclopropyl-4-[(1S)-1-ethylbutyl]-1,2,4-triazole-3-thiol 5-cyclopropyl-4-[(1S)-1-ethylbut…
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) | 2.20 | 9.17 | -10.06 | 1 | 3 | 0 | 34 | 225.361 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.93 | 9.29 | -46.96 | 0 | 3 | -1 | 31 | 224.353 | 5 | ↓ |