In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 15th, 2010 | 20 | Yes |
Popular Name: (1S)-1-(3-chlorophenyl)-N-[(1-ethyl-4-piperidyl)methyl]propan-1-amine (1S)-1-(3-chlorophenyl)-N-[(1-et…
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) | 3.49 | 10.95 | -101.11 | 3 | 2 | 2 | 21 | 296.886 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.49 | 9.71 | -33.36 | 2 | 2 | 1 | 16 | 295.878 | 6 | ↓ |