In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 18th, 2009 | 32 | Yes |
Popular Name: N-butyl-5-[(3-chloro-4-fluoro-phenyl)sulfonylamino]-N-methyl-2-piperazin-1-yl-benzamide N-butyl-5-[(3-chloro-4-fluoro-ph…
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) | 3.20 | 6.74 | -53.03 | 3 | 7 | 1 | 86 | 484.017 | 8 | ↓ |
Hi High (pH 8-9.5) | 3.20 | 5.39 | -39 | 1 | 7 | -1 | 84 | 482.001 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.20 | 6.81 | -64.18 | 2 | 7 | 0 | 88 | 483.009 | 8 | ↓ |