In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2008 | 20 | No |
Popular Name: N-(4-chloro-3-nitro-phenyl)-2-piperazin-1-yl-acetamide N-(4-chloro-3-nitro-phenyl)-2-pi…
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) | 1.38 | 4.08 | -49.87 | 3 | 7 | 1 | 91 | 299.738 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.38 | 3.25 | -51.13 | 3 | 7 | 1 | 95 | 299.738 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.38 | 1.83 | -11.98 | 2 | 7 | 0 | 90 | 298.73 | 4 | ↓ |