| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 15th, 2011 | 19 | Yes |
Popular Name: 4-(cyclopentylsulfanyl)quinoline-3-carboxylic acid 4-(cyclopentylsulfanyl)quinoline…
Find On: PubMed — Wikipedia — Google
CAS Number: 1275908-47-8
| 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) | 3.56 | 8.99 | -52.25 | 0 | 3 | -1 | 53 | 272.349 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 3.56 | 9.4 | -39.88 | 1 | 3 | 0 | 54 | 273.357 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 111 - 113 | Enamine Building Blocks |
| MP | 111...113 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
No pre-computed analogs available. Try a structural similarity search.
