In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 14th, 2009 | 28 | Yes |
Popular Name: (3R,6S)-1-benzyl-6-(4-ethylphenyl)-N-[(1S)-1-methylpropyl]piperidine-3-carboxamide (3R,6S)-1-benzyl-6-(4-ethylpheny…
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) | 5.33 | 13.95 | -36.95 | 2 | 3 | 1 | 34 | 379.568 | 7 | ↓ |
Hi High (pH 8-9.5) | 5.33 | 12.04 | -7.57 | 1 | 3 | 0 | 32 | 378.56 | 7 | ↓ |