In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 30th, 2010 | 34 | Yes |
Popular Name: 4-(4-chlorophenyl)sulfonyl-N-(4-ethyl-1,3-benzothiazol-2-yl)-N-(4-pyridylmethyl)butanamide 4-(4-chlorophenyl)sulfonyl-N-(4-…
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) | 3.94 | 12.2 | -31.17 | 0 | 6 | 0 | 80 | 514.072 | 9 | ↓ |
Lo Low (pH 4.5-6) | 3.94 | 12.66 | -68.73 | 1 | 6 | 1 | 81 | 515.08 | 9 | ↓ |