In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 13th, 2010 | 30 | Yes |
Popular Name: (4-dimethylaminophenyl)-[(3S)-3-[4-(o-tolyl)piperazin-1-yl]-1-piperidyl]methanone (4-dimethylaminophenyl)-[(3S)-3-…
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) | 3.42 | 10.62 | -10.09 | 0 | 5 | 0 | 30 | 406.574 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.42 | 10.64 | -35.65 | 1 | 5 | 1 | 31 | 407.582 | 4 | ↓ |