In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 21 | Yes |
Popular Name: N'-[(3S)-1-benzyl-3-piperidyl]-N,N-dimethyl-butane-1,4-diamine N'-[(3S)-1-benzyl-3-piperidyl]-N…
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) | 2.49 | 10.88 | -184.23 | 4 | 3 | 3 | 25 | 292.491 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.49 | 9.72 | -78.71 | 3 | 3 | 2 | 21 | 291.483 | 8 | ↓ |
Lo Low (pH 4.5-6) | 2.49 | 8.67 | -96.06 | 3 | 3 | 2 | 24 | 291.483 | 8 | ↓ |