BDBM36124 AC-TMA2-beta-cyclodextrin

SMILES: C[N+](C)(C)C[C@H]1O[C@@H]2O[C@@H]3[C@@H](CO)O[C@H](O[C@@H]4[C@@H](C[N+](C)(C)C)O[C@H](O[C@@H]5[C@@H](CO)O[C@H](O[C@@H]6[C@@H](CO)O[C@H](O[C@@H]7[C@@H](CO)O[C@H](O[C@@H]8[C@@H](CO)O[C@H](O[C@H]1[C@H](O)[C@H]2O)[C@H](O)[C@H]8O)[C@H](O)[C@H]7O)[C@H](O)[C@H]6O)[C@H](O)[C@H]5O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O

InChI Key: InChIKey=HQXAADHKLGPAQZ-IHHCOHTPSA-N

Data: 8 ITC

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- ITC Data from BindingDB

Found 8 hits for monomerid = 36124

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
BDBM36124	BDBM50043820	PC cid PC sid	CHEBI KEGG PC cid PC sid		-3.16	1.55	-4.71	2.31	6.90	25
Nagoya Institute of Technology					J Am Chem Soc 126: 14224-33 (2004)
BDBM36124	BDBM50043802	PC cid PC sid	CHEBI KEGG MMDB PC cid PC sid PDB		-3.16	1.50	-4.66	2.32	6.90	25
Nagoya Institute of Technology					J Am Chem Soc 126: 14224-33 (2004)
BDBM36124	BDBM36121	PC cid PC sid	PC cid PC sid		-2.99	0.142	-3.13	2.20	6.90	25
Nagoya Institute of Technology					J Am Chem Soc 126: 14224-33 (2004)
BDBM36124	BDBM36122	PC cid PC sid	PC cid PC sid		-2.85	0.385	-3.22	2.09	6.90	25
Nagoya Institute of Technology					J Am Chem Soc 126: 14224-33 (2004)
BDBM36124	BDBM36120	PC cid PC sid	MMDB PC cid PC sid		n/a	-0.762	-2.13	2.12	6.90	25
Nagoya Institute of Technology					J Am Chem Soc 123: 5360-5361 (2000)
BDBM36124	BDBM36119	PC cid PC sid	KEGG MMDB PC cid PC sid		n/a	-1.17	-1.64	2.05	6.90	25
Nagoya Institute of Technology					J Am Chem Soc 123: 5360-5361 (2000)
BDBM36124	BDBM36137	PC cid PC sid	KEGG MMDB PC cid PC sid PDB		n/a	-0.669	-2.26	2.15	6.90	25
Nagoya Institute of Technology					J Am Chem Soc 123: 5360-5361 (2000)
BDBM36124	BDBM36138	PC cid PC sid	KEGG MMDB PC cid PC sid		n/a	-0.762	-2.13	2.13	6.90	25
Nagoya Institute of Technology					J Am Chem Soc 123: 5360-5361 (2000)