| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 19th, 2011 | 22 | Yes |
Popular Name: (4R)-1-methyl-4-(4-thiazol-2-yl-1,4-diazepane-1-carbonyl)piperidin-2-one (4R)-1-methyl-4-(4-thiazol-2-yl-…
| 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) | 0.70 | 6.56 | -13.09 | 0 | 6 | 0 | 57 | 322.434 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 0.70 | 6.95 | -39.34 | 1 | 6 | 1 | 58 | 323.442 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
