In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 18th, 2008 | 25 | Yes |
Popular Name: N-butyl-3-[(2S)-2-[(4-methoxyphenyl)methyl]-5-oxo-pyrrolidin-2-yl]-N-methyl-propanamide N-butyl-3-[(2S)-2-[(4-methoxyphe…
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) | 3.07 | 8.09 | -16.61 | 1 | 5 | 0 | 59 | 346.471 | 9 | ↓ |
Popular Name: (5S)-5-[(4-methoxyphenyl)methyl]-5-[3-oxo-3-(1-piperidyl)propyl]pyrrolidin-2-one (5S)-5-[(4-methoxyphenyl)methyl]…
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) | 2.54 | -0.73 | -16.31 | 1 | 5 | 0 | 59 | 344.455 | 6 | ↓ |
Popular Name: (5R)-5-[(4-methoxyphenyl)methyl]-5-[3-oxo-3-(1-piperidyl)propyl]pyrrolidin-2-one (5R)-5-[(4-methoxyphenyl)methyl]…
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) | 2.54 | -0.94 | -16.7 | 1 | 5 | 0 | 59 | 344.455 | 6 | ↓ |