| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 11th, 2006 | 30 | No |
Popular Name: 2-benzylsulfanyl-4-(4-isopropylphenyl)-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carbonitrile 2-benzylsulfanyl-4-(4-isopropylp…
| 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 | 0.79 | -9.34 | 0 | 3 | 0 | 53 | 414.574 | 5 | ↓ |
| Mid Mid (pH 6-8) | 6.22 | 1.37 | -14.21 | 0 | 3 | 0 | 53 | 414.574 | 5 | ↓ |
