In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 23rd, 2009 | 16 | Yes |
Popular Name: 3-amino-1-[(2S)-2-(3-pyridyl)pyrrolidin-1-yl]propan-1-one 3-amino-1-[(2S)-2-(3-pyridyl)pyr…
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) | -0.51 | 3.3 | -50.92 | 3 | 4 | 1 | 61 | 220.296 | 3 | ↓ |
Lo Low (pH 4.5-6) | -0.51 | 3.77 | -92.67 | 4 | 4 | 2 | 62 | 221.304 | 3 | ↓ |