In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 16th, 2008 | 13 | Yes |
Popular Name: 4-BROMO-1H-INDOLE-3-CARBOXYLIC ACID 4-BROMO-1H-INDOLE-3-CARBOXYLIC ACID
Find On: PubMed — Wikipedia — Google
CAS Number: 110811-31-9
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) | 2.42 | -1.06 | -55.52 | 1 | 3 | -1 | 56 | 239.048 | 1 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 145 - 147 | Enamine Building Blocks |
MP | 145...147 | Enamine Building Blocks |
MP | 159 - 161 | Enamine Building Blocks |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
No pre-computed analogs available. Try a structural similarity search.