BDBM36060 (S)-3-bromo-2-methylpropionic acid methyl ester
SMILES: COC(=O)[C@H](C)CBr
InChI Key: InChIKey=FKWNAVCXZSQYTA-SCSAIBSYSA-N
Data: 1 ITC
Cell (A) | Syringe (B) | Cell Links | Syringe Links | Cell + Syr Links | ΔG° kcal/mole | -TΔS° kcal/mole | ΔH° kcal/mole | log K | pH | Temp °C |
---|---|---|---|---|---|---|---|---|---|---|
BDBM11 | BDBM36060 | CHEBI KEGG MMDB PC cid PC sid PDB | PC cid PC sid | -3.32 | -0.356 | -2.96 | 2.43 | 6.90 | 25 | |
Japan Science and Technology Agency | J Am Chem Soc 122: 4418-35 (2000) |