In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 30th, 2010 | 31 | Yes |
Popular Name: 4-(4-fluorophenyl)sulfanyl-N-(6-methyl-1,3-benzothiazol-2-yl)-N-(4-pyridylmethyl)butanamide 4-(4-fluorophenyl)sulfanyl-N-(6-…
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) | 4.55 | 14.52 | -19.41 | 0 | 4 | 0 | 46 | 451.592 | 8 | ↓ |
Lo Low (pH 4.5-6) | 4.55 | 14.98 | -54.5 | 1 | 4 | 1 | 47 | 452.6 | 8 | ↓ |