In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 25th, 2007 | 29 | Yes |
Popular Name: 2-(1-naphthylmethylsulfanyl)-6-(2-thienyl)-4-(trifluoromethyl)pyridine-3-carbonitrile 2-(1-naphthylmethylsulfanyl)-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) | 6.60 | 3.27 | -7.84 | 0 | 2 | 0 | 36 | 426.488 | 5 | ↓ |
Lo Low (pH 4.5-6) | 6.60 | 3.49 | -38.47 | 1 | 2 | 1 | 37 | 427.496 | 5 | ↓ |