In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 6th, 2010 | 17 | No |
Popular Name: 4-amino-5-(4-tert-butylcyclohexyl)-1,2,4-triazole-3-thiol 4-amino-5-(4-tert-butylcyclohexy…
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) | 1.92 | 7.24 | -8.71 | 3 | 4 | 0 | 60 | 254.403 | 2 | ↓ |
Hi High (pH 8-9.5) | 2.65 | 7.15 | -40.49 | 2 | 4 | -1 | 57 | 253.395 | 2 | ↓ |