In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 9th, 2010 | 28 | Yes |
Popular Name: N-(4-ethylphenyl)-6-[(2R)-2-(3-pyridyl)pyrrolidin-1-yl]pyridine-3-carboxamide N-(4-ethylphenyl)-6-[(2R)-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) | 3.70 | 10.97 | -12.86 | 1 | 5 | 0 | 58 | 372.472 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.70 | 11.48 | -36.01 | 2 | 5 | 1 | 59 | 373.48 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.70 | 11.93 | -94.39 | 3 | 5 | 2 | 61 | 374.488 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.70 | 11.39 | -43.12 | 2 | 5 | 1 | 59 | 373.48 | 5 | ↓ |