In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 9th, 2010 | 28 | Yes |
Popular Name: N-(4-ethylphenyl)-2-[(2R)-2-(4-pyridyl)pyrrolidin-1-yl]pyridine-3-carboxamide N-(4-ethylphenyl)-2-[(2R)-2-(4-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) | 3.59 | 12.31 | -35.01 | 2 | 5 | 1 | 59 | 373.48 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.59 | 11.86 | -10.34 | 1 | 5 | 0 | 58 | 372.472 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.59 | 12.78 | -94.56 | 3 | 5 | 2 | 61 | 374.488 | 5 | ↓ |