| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 15th, 2005 | 17 | Yes |
Popular Name: 6-(3-bromophenyl)-2-methylnicotinic acid 6-(3-bromophenyl)-2-methylnicoti…
Find On: PubMed — Wikipedia — Google
CAS Number: 791787-06-9
| 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) | 3.34 | 8.13 | -47.64 | 0 | 3 | -1 | 53 | 291.124 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 3.34 | 8.45 | -37.73 | 1 | 3 | 0 | 54 | 292.132 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 181 - 183 | Enamine Building Blocks |
| MP | 181...183 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
