| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 2nd, 2009 | 28 | No |
Popular Name: 1-[(1S,2R)-1-(4-ethylpiperazine-1-carbonyl)-2-methyl-butyl]-3-(4-nitrophenyl)urea 1-[(1S,2R)-1-(4-ethylpiperazine-…
| 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) | 2.64 | 5.99 | -10.55 | 2 | 9 | 0 | 110 | 391.472 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.64 | 8.54 | -50.14 | 3 | 9 | 1 | 112 | 392.48 | 7 | ↓ |
