| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2009 | 19 | No |
Popular Name: 4-cyclohexyl-5-[methyl-[(1S)-1-methylbutyl]amino]-1,2,4-triazole-3-thiol 4-cyclohexyl-5-[methyl-[(1S)-1-m…
| 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) | 3.54 | 11.77 | -9.23 | 1 | 4 | 0 | 37 | 282.457 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 4.27 | 10.77 | -45.18 | 1 | 4 | 0 | 35 | 282.457 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
