In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 22nd, 2008 | 28 | Yes |
Popular Name: (3S)-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-1-phenethyl-piperidin-3-amine (3S)-N-[2-(3,4-dimethoxyphenyl)e…
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) | 4.02 | 11.36 | -44.47 | 1 | 4 | 1 | 26 | 383.556 | 9 | ↓ |
Hi High (pH 8-9.5) | 4.02 | 11.35 | -47.61 | 1 | 4 | 1 | 26 | 383.556 | 9 | ↓ |
Hi High (pH 8-9.5) | 4.02 | 9.02 | -7.12 | 0 | 4 | 0 | 25 | 382.548 | 9 | ↓ |