In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 3rd, 2011 | 29 | Yes |
Popular Name: N-(5-cyano-2-isopropoxy-phenyl)-4-(cyclohexanecarbonyl)piperazine-1-carboxamide N-(5-cyano-2-isopropoxy-phenyl)-…
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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) | 3.67 | 9.63 | -14.06 | 1 | 7 | 0 | 86 | 398.507 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.