In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 21st, 2011 | 21 | Yes |
Popular Name: N-[[1-[(6-chloro-3-pyridyl)methyl]-4-piperidyl]methyl]-N-methyl-butan-1-amine N-[[1-[(6-chloro-3-pyridyl)methy…
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) | 3.77 | 11.05 | -106.26 | 2 | 3 | 2 | 22 | 311.901 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.77 | 8.8 | -39.13 | 1 | 3 | 1 | 21 | 310.893 | 7 | ↓ |