In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2010 | 28 | Yes |
Popular Name: (2S,3S)-1-butyl-2-(4-methoxyphenyl)-5-oxo-N-(4-pyridylmethyl)pyrrolidine-3-carboxamide (2S,3S)-1-butyl-2-(4-methoxyphen…
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) | 2.46 | 8.15 | -14.32 | 1 | 6 | 0 | 72 | 381.476 | 8 | ↓ |
Lo Low (pH 4.5-6) | 2.46 | 8.61 | -47.91 | 2 | 6 | 1 | 73 | 382.484 | 8 | ↓ |