In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 27th, 2010 | 22 | Yes |
Popular Name: N-[(3-chlorophenyl)methyl]-1-(1-hexyl-4-piperidyl)methanamine N-[(3-chlorophenyl)methyl]-1-(1-…
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) | 5.40 | 12.68 | -105.02 | 3 | 2 | 2 | 21 | 324.94 | 9 | ↓ |
Hi High (pH 8-9.5) | 5.40 | 11.44 | -34.39 | 2 | 2 | 1 | 16 | 323.932 | 9 | ↓ |