In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2007 | 32 | Yes |
Popular Name: 4-(4-chlorophenyl)sulfanyl-N-(6-ethylbenzothiazol-2-yl)-N-(3-pyridylmethyl)butanamide 4-(4-chlorophenyl)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) | 5.58 | -0.07 | -19.56 | 0 | 4 | 0 | 46 | 482.074 | 9 | ↓ |
Lo Low (pH 4.5-6) | 5.58 | 0.04 | -50.02 | 1 | 4 | 1 | 47 | 483.082 | 9 | ↓ |