In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2009 | 21 | Yes |
Popular Name: 2-(4-aminophenyl)-1-[(2S)-2-(3-pyridyl)pyrrolidin-1-yl]ethanone 2-(4-aminophenyl)-1-[(2S)-2-(3-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) | 1.29 | 6.82 | -12.55 | 2 | 4 | 0 | 59 | 281.359 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.29 | 7.29 | -36.33 | 3 | 4 | 1 | 60 | 282.367 | 3 | ↓ |