In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 28th, 2009 | 23 | No |
Popular Name: N-(4,5-dimethyl-2-nitro-phenyl)-2-(4-ethylpiperazin-1-yl)acetamide N-(4,5-dimethyl-2-nitro-phenyl)-…
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) | 2.49 | 7.21 | -41.06 | 2 | 7 | 1 | 83 | 321.401 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.49 | 5 | -7.77 | 1 | 7 | 0 | 81 | 320.393 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.49 | 7.28 | -37.78 | 2 | 7 | 1 | 83 | 321.401 | 5 | ↓ |