In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 18th, 2009 | 32 | Yes |
Popular Name: 5-[(4-tert-butylphenyl)sulfonylamino]-2-piperazin-1-yl-N-propyl-benzamide 5-[(4-tert-butylphenyl)sulfonyla…
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) | 3.81 | 6.88 | -50.44 | 4 | 7 | 1 | 95 | 459.636 | 8 | ↓ |
Hi High (pH 8-9.5) | 3.81 | 6.96 | -64.48 | 3 | 7 | 0 | 97 | 458.628 | 8 | ↓ |
Hi High (pH 8-9.5) | 3.81 | 5.47 | -15.91 | 3 | 7 | 0 | 91 | 458.628 | 8 | ↓ |