| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 25th, 2004 | 27 | Yes |
Popular Name: 2-[(2-cyanobenzyl)sulfanyl]-6-thien-2-yl-4-(trifluoromethyl)nicotinonitrile 2-[(2-cyanobenzyl)sulfanyl]-6-th…
| 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) | 5.14 | 4.4 | -10.55 | 0 | 3 | 0 | 60 | 401.438 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 5.14 | 4.62 | -37.11 | 1 | 3 | 1 | 61 | 402.446 | 5 | ↓ |
