| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 26th, 2010 | 17 | Yes |
Popular Name: N-methyl-N-[(1R,2R)-2-methylcyclohexyl]-5-oxo-1,2-dihydro-1,2,4-triazole-3-carboxamide N-methyl-N-[(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) | 1.18 | 1.56 | -46.47 | 1 | 6 | -1 | 85 | 237.283 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 1.18 | 1.87 | -21.12 | 2 | 6 | 0 | 86 | 238.291 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 0.73 | 3.25 | -9.87 | 2 | 6 | 0 | 82 | 238.291 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
