In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 21 | Yes |
Popular Name: (5-amino-2-bromo-phenyl)-[(2S)-2-(3-pyridyl)pyrrolidin-1-yl]methanone (5-amino-2-bromo-phenyl)-[(2S)-2…
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) | 1.47 | 6.36 | -12.76 | 2 | 4 | 0 | 59 | 346.228 | 2 | ↓ |
Lo Low (pH 4.5-6) | 1.47 | 6.83 | -38.14 | 3 | 4 | 1 | 60 | 347.236 | 2 | ↓ |