| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 7th, 2005 | 21 | Yes |
Popular Name: 3-(methylsulfanyl)-2-phenyl-4-quinolinecarboxylic acid 3-(methylsulfanyl)-2-phenyl-4-qu…
Find On: PubMed — Wikipedia — Google
CAS Number: 400079-66-5
| 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) | 4.00 | 9.93 | -55.15 | 0 | 3 | -1 | 53 | 294.355 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 286 | KeyOrganics |
No pre-computed analogs available. Try a structural similarity search.
