In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 18th, 2009 | 33 | Yes |
Popular Name: N-butyl-5-[(4-isopropylphenyl)sulfonylamino]-N-methyl-2-piperazin-1-yl-benzamide N-butyl-5-[(4-isopropylphenyl)su…
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) | 3.95 | 8.12 | -54.85 | 3 | 7 | 1 | 86 | 473.663 | 9 | ↓ |
Hi High (pH 8-9.5) | 3.95 | 6.7 | -14.91 | 2 | 7 | 0 | 82 | 472.655 | 9 | ↓ |
Hi High (pH 8-9.5) | 3.95 | 8.19 | -73.43 | 2 | 7 | 0 | 88 | 472.655 | 9 | ↓ |