| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 9th, 2010 | 30 | Yes |
Popular Name: N-(4-isopropylphenyl)-6-[(3S)-3-phenylpiperazin-1-yl]pyridine-3-carboxamide N-(4-isopropylphenyl)-6-[(3S)-3-…
| 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) | 4.78 | 11.64 | -51.12 | 3 | 5 | 1 | 62 | 401.534 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.78 | 10.54 | -9.3 | 2 | 5 | 0 | 57 | 400.526 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 4.78 | 11.99 | -112.97 | 4 | 5 | 2 | 63 | 402.542 | 5 | ↓ |
