| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 2nd, 2012 | 14 | Yes |
Popular Name: 2-methyl-4H-chromene-3-carboxylic acid 2-methyl-4H-chromene-3-carboxyli…
Find On: PubMed — Wikipedia — Google
CAS Number: 1354953-33-5
| 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) | 2.36 | 6.68 | -48.65 | 0 | 3 | -1 | 49 | 189.19 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 2.36 | 4.67 | -5.88 | 1 | 3 | 0 | 47 | 190.198 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 234 - 236 | Enamine Building Blocks |
| MP | 234...236 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
No pre-computed analogs available. Try a structural similarity search.
