| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 21st, 2010 | 20 | Yes |
Popular Name: 2-[[4-methyl-5-[methyl-(4-methylcyclohexyl)amino]-1,2,4-triazol-3-yl]sulfanyl]acetic 2-[[4-methyl-5-[methyl-(4-methyl…
| 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) | 1.72 | 10.71 | -49.25 | 0 | 6 | -1 | 74 | 297.404 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.72 | 10.87 | -36.48 | 1 | 6 | 0 | 75 | 298.412 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
