In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 20th, 2010 | 27 | Yes |
Popular Name: 4-[(3,4-dimethoxyphenyl)methyl-methyl-amino]-2-methylsulfanyl-quinoline-3-carbonitrile 4-[(3,4-dimethoxyphenyl)methyl-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) | 3.94 | 10.57 | -9.35 | 0 | 5 | 0 | 58 | 379.485 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.