In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 21 | Yes |
Popular Name: (3S)-3-amino-4-[(2R)-2-(4-methoxyphenyl)pyrrolidin-1-yl]-4-oxo-butanamide (3S)-3-amino-4-[(2R)-2-(4-methox…
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) | 0.79 | 1.19 | -41.32 | 5 | 6 | 1 | 100 | 292.359 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.79 | 0.83 | -14.15 | 4 | 6 | 0 | 99 | 291.351 | 5 | ↓ |