| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 9th, 2010 | 26 | Yes |
Popular Name: N-(4-tert-butylphenyl)-2-[(3S)-3-methylpiperazin-1-yl]pyridine-3-carboxamide N-(4-tert-butylphenyl)-2-[(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) | 3.67 | 9.46 | -36.03 | 3 | 5 | 1 | 62 | 353.49 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.67 | 8.19 | -9.79 | 2 | 5 | 0 | 57 | 352.482 | 4 | ↓ |
