In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 8th, 2009 | 33 | Yes |
Popular Name: 4-phenyl-1-[[(3S,4S)-4-phenyl-1-(3-phenylpropyl)pyrrolidin-3-yl]methyl]piperidine 4-phenyl-1-[[(3S,4S)-4-phenyl-1-…
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) | 7.46 | 19.9 | -132.8 | 2 | 2 | 2 | 9 | 440.675 | 8 | ↓ |
Mid Mid (pH 6-8) | 7.46 | 17.39 | -42.67 | 1 | 2 | 1 | 8 | 439.667 | 8 | ↓ |
Mid Mid (pH 6-8) | 7.46 | 17.82 | -43.37 | 1 | 2 | 1 | 8 | 439.667 | 8 | ↓ |