In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 25th, 2009 | 23 | Yes |
Popular Name: 3-[[[(2S)-2-phenyl-2-(1-piperidyl)ethyl]amino]methyl]phenol 3-[[[(2S)-2-phenyl-2-(1-piperidy…
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) | 3.51 | 7.82 | -40.78 | 3 | 3 | 1 | 37 | 311.449 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.51 | 9.11 | -128.7 | 4 | 3 | 2 | 41 | 312.457 | 6 | ↓ |