| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 4th, 2006 | 30 | Yes |
Popular Name: 2-{[6-(1-adamantyl)-3-cyano-4-(trifluoromethyl)pyridin-2-yl]sulfanyl}-N-isopropylacetamide 2-{[6-(1-adamantyl)-3-cyano-4-(t…
| 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) | 5.31 | 10.72 | -11.46 | 1 | 4 | 0 | 66 | 437.531 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 5.31 | 10.86 | -47.03 | 2 | 4 | 1 | 67 | 438.539 | 6 | ↓ |
