In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 3rd, 2011 | 26 | Yes |
Popular Name: 4-(cyclohexanecarbonyl)-N-[2-(dimethylamino)phenyl]piperazine-1-carboxamide 4-(cyclohexanecarbonyl)-N-[2-(di…
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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) | 3.25 | 9.49 | -13.46 | 1 | 6 | 0 | 56 | 358.486 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.25 | 9.85 | -52.85 | 2 | 6 | 1 | 57 | 359.494 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.