| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 30th, 2009 | 22 | Yes |
Popular Name: 4-(2-diethylaminoethylamino)-2-methylsulfanyl-quinoline-3-carbonitrile 4-(2-diethylaminoethylamino)-2-m…
| 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) | 3.44 | 8.3 | -40.16 | 2 | 4 | 1 | 53 | 315.466 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.44 | 6.21 | -8.76 | 1 | 4 | 0 | 52 | 314.458 | 7 | ↓ |
