In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 18th, 2009 | 31 | Yes |
Popular Name: 5-[(3-chloro-4-fluoro-phenyl)sulfonylamino]-N-isobutyl-2-piperazin-1-yl-benzamide 5-[(3-chloro-4-fluoro-phenyl)sul…
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) | 3.12 | 5.89 | -50.37 | 4 | 7 | 1 | 95 | 469.99 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.12 | 4.54 | -36.32 | 2 | 7 | -1 | 93 | 467.974 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.12 | 5.96 | -56.94 | 3 | 7 | 0 | 97 | 468.982 | 7 | ↓ |