In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 8th, 2008 | 33 | Yes |
Popular Name: N-butyl-N-ethyl-5-[(4-ethylphenyl)sulfonylamino]-2-piperazin-1-yl-benzamide N-butyl-N-ethyl-5-[(4-ethylpheny…
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) | 3.73 | 8.44 | -54.7 | 3 | 7 | 1 | 86 | 473.663 | 10 | ↓ |
Hi High (pH 8-9.5) | 3.73 | 7.02 | -15.05 | 2 | 7 | 0 | 82 | 472.655 | 10 | ↓ |
Hi High (pH 8-9.5) | 3.73 | 8.51 | -73.82 | 2 | 7 | 0 | 88 | 472.655 | 10 | ↓ |