| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 18th, 2006 | 24 | No |
Popular Name: 2-[(4-methylpiperazin-1-yl)carbonylmethyl]-4-nitro-isoindoline-1,3-dione 2-[(4-methylpiperazin-1-yl)carbo…
| 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) | 0.36 | 8.02 | -55.28 | 1 | 9 | 1 | 110 | 333.324 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.36 | 5.67 | -21.32 | 0 | 9 | 0 | 108 | 332.316 | 3 | ↓ |
