In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 30th, 2010 | 23 | Yes |
Popular Name: 3-[(2S)-2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]-N-isopropyl-propanamide 3-[(2S)-2-(3,4-dimethoxyphenyl)p…
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) | 2.02 | 7.38 | -45.6 | 2 | 5 | 1 | 52 | 321.441 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.02 | 5.58 | -11.78 | 1 | 5 | 0 | 51 | 320.433 | 7 | ↓ |