| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 24th, 2009 | 18 | No |
Popular Name: 2-(4-isopropylpiperazin-1-yl)pyridine-4-carbothioamide 2-(4-isopropylpiperazin-1-yl)pyr…
| 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) | 1.46 | 6.59 | -40.87 | 3 | 4 | 1 | 47 | 265.406 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.46 | 4.43 | -12.08 | 2 | 4 | 0 | 45 | 264.398 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.46 | 6.92 | -101.95 | 4 | 4 | 2 | 48 | 266.414 | 3 | ↓ |
