| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 7th, 2009 | 30 | Yes |
Popular Name: 3-bromo-N-[3-(4-methylpiperazin-1-yl)propyl]-N-(3-oxo-3-piperazin-1-yl-propyl)benzamide 3-bromo-N-[3-(4-methylpiperazin-…
| 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) | 0.80 | 8.1 | -96.7 | 3 | 7 | 2 | 65 | 482.467 | 8 | ↓ |
| Hi High (pH 8-9.5) | 0.80 | 4.44 | -14.37 | 1 | 7 | 0 | 59 | 480.451 | 8 | ↓ |
| Hi High (pH 8-9.5) | 0.80 | 6.72 | -59.57 | 2 | 7 | 1 | 60 | 481.459 | 8 | ↓ |
| Mid Mid (pH 6-8) | 0.80 | 6.81 | -49.35 | 2 | 7 | 1 | 60 | 481.459 | 8 | ↓ |
