| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 9th, 2010 | 29 | Yes |
Popular Name: N-(4-isopropylphenyl)-2-[(2R)-2-(4-pyridyl)pyrrolidin-1-yl]pyridine-3-carboxamide N-(4-isopropylphenyl)-2-[(2R)-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) | 4.19 | 12.79 | -34.85 | 2 | 5 | 1 | 59 | 387.507 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.19 | 12.33 | -10.13 | 1 | 5 | 0 | 58 | 386.499 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 4.19 | 13.26 | -94.52 | 3 | 5 | 2 | 61 | 388.515 | 5 | ↓ |
