In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 3rd, 2011 | 17 | Yes |
Popular Name: N-propyl-N-[(3S)-pyrrolidin-3-yl]pyridine-3-carboxamide N-propyl-N-[(3S)-pyrrolidin-3-yl…
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) | 0.45 | 4.24 | -36.41 | 2 | 4 | 1 | 50 | 234.323 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.45 | 2.79 | -7.4 | 1 | 4 | 0 | 45 | 233.315 | 4 | ↓ |