In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2008 | 21 | Yes |
Popular Name: N-[[4-(diethylaminomethyl)phenyl]methyl]-1-methyl-piperidin-4-amine N-[[4-(diethylaminomethyl)phenyl…
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) | 2.47 | 9.71 | -73.2 | 3 | 3 | 2 | 21 | 291.483 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.47 | 8.59 | -87.13 | 3 | 3 | 2 | 24 | 291.483 | 7 | ↓ |
Lo Low (pH 4.5-6) | 2.47 | 11.01 | -161.65 | 4 | 3 | 3 | 25 | 292.491 | 7 | ↓ |