In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 29th, 2009 | 24 | Yes |
Popular Name: 3-chloro-N-[[(3S,4S)-1-(3,3-dimethylbutyl)-3-fluoro-4-piperidyl]methyl]benzamide 3-chloro-N-[[(3S,4S)-1-(3,3-dime…
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) | 4.58 | 10.68 | -49.16 | 2 | 3 | 1 | 34 | 355.905 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.58 | 8.46 | -7.5 | 1 | 3 | 0 | 32 | 354.897 | 6 | ↓ |