In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2007 | 30 | Yes |
Popular Name: N-benzothiazol-2-yl-4-(4-chlorophenyl)sulfanyl-N-(3-pyridylmethyl)butanamide N-benzothiazol-2-yl-4-(4-chlorop…
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) | 4.69 | -0.42 | -24.13 | 0 | 4 | 0 | 46 | 454.02 | 8 | ↓ |
Lo Low (pH 4.5-6) | 4.69 | -0.31 | -57.32 | 1 | 4 | 1 | 47 | 455.028 | 8 | ↓ |