| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 8th, 2008 | 16 | Yes |
Popular Name: 6-(4-Methylpiperazin-1-yl)nicotinic acid 6-(4-Methylpiperazin-1-yl)nicoti…
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CAS Number: 132521-70-1
None
| 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) | 0.61 | 2.51 | -41.59 | 1 | 5 | 0 | 61 | 221.26 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.61 | 4.71 | -73.77 | 1 | 5 | 0 | 61 | 221.26 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.61 | 2.24 | -47.57 | 0 | 5 | -1 | 59 | 220.252 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.61 | 4.98 | -98.53 | 2 | 5 | 1 | 62 | 222.268 | 2 | ↓ |
