| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 14th, 2010 | 21 | No |
Popular Name: 1-isobutyl-4-[(1S)-1-(3-nitrophenyl)ethyl]piperazine 1-isobutyl-4-[(1S)-1-(3-nitrophe…
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| 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) | 3.25 | 9.58 | -42.16 | 1 | 5 | 1 | 53 | 292.403 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.25 | 7.62 | -5.32 | 0 | 5 | 0 | 52 | 291.395 | 5 | ↓ |
