In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 18th, 2009 | 33 | Yes |
Popular Name: N-butyl-5-[(3-chloro-4-methyl-phenyl)sulfonylamino]-N-ethyl-2-piperazin-1-yl-benzamide N-butyl-5-[(3-chloro-4-methyl-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) | 3.87 | 8.1 | -52.79 | 3 | 7 | 1 | 86 | 494.081 | 9 | ↓ |
Hi High (pH 8-9.5) | 3.87 | 8.17 | -69.63 | 2 | 7 | 0 | 88 | 493.073 | 9 | ↓ |
Hi High (pH 8-9.5) | 3.87 | 6.75 | -44.73 | 1 | 7 | -1 | 84 | 492.065 | 9 | ↓ |