| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 17th, 2009 | 17 | Yes |
Popular Name: methyl 3-amino-5-(3-bromophenyl)thiophene-2-carboxylate methyl 3-amino-5-(3-bromophenyl)…
Find On: PubMed — Wikipedia — Google
CAS Number: 1094398-45-4
| 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) | 3.78 | 6.57 | -7.93 | 2 | 3 | 0 | 52 | 312.188 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 3.78 | 6.4 | -41.54 | 3 | 3 | 1 | 54 | 313.196 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 107 - 109 | Enamine Building Blocks |
| MP | 107...109 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
