In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 23rd, 2008 | 23 | No |
Popular Name: 4-(2,5-dimethoxyphenyl)-2-sulfanyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile 4-(2,5-dimethoxyphenyl)-2-sulfan…
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) | 4.30 | 8.02 | -54.44 | 0 | 4 | -1 | 55 | 325.413 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.