In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 15th, 2010 | 19 | Yes |
Popular Name: N-[(4-chloro-3-fluoro-phenyl)methyl]-1-(1-ethyl-4-piperidyl)methanamine N-[(4-chloro-3-fluoro-phenyl)met…
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) | 3.45 | 9.65 | -108.76 | 3 | 2 | 2 | 21 | 286.822 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.45 | 8.42 | -34.6 | 2 | 2 | 1 | 16 | 285.814 | 5 | ↓ |