In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 3rd, 2010 | 23 | Yes |
Popular Name: 1-[(3,5-dimethylphenyl)methyl]-N-pentyl-piperidine-4-carboxamide 1-[(3,5-dimethylphenyl)methyl]-N…
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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) | 4.39 | 10.92 | -45.53 | 2 | 3 | 1 | 34 | 317.497 | 7 | ↓ |
Hi High (pH 8-9.5) | 4.39 | 8.67 | -8.81 | 1 | 3 | 0 | 32 | 316.489 | 7 | ↓ |