In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2010 | 28 | No |
Popular Name: N-(2-acetylphenyl)-2-[4-(3-nitrophenyl)piperazin-1-yl]acetamide N-(2-acetylphenyl)-2-[4-(3-nitro…
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) | 2.89 | 8.34 | -13.81 | 1 | 8 | 0 | 98 | 382.42 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.89 | 10.5 | -48.75 | 2 | 8 | 1 | 100 | 383.428 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.