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BDBM271401 4- {[(1R,2R,5R,10S,13R,14R, 17S,19R)-5-[(1R)-2- {[(4- chlorophenyl)methyl][2- (dimethylamino)ethyl] amino}-1-hydroxyethyl]- 1,2,14,18,18- pentamethyl-7-oxo-8- (propan-2- yl)pentacyclo[11.8.0.0{circumflex over ()} {2,10}.0{circumflex over ()}{5,9}.0{circumflex over ()}{14,19}] henicos-8-en-17-yl]oxy}- 2,2-dimethyl-4- oxobutanoic acid::US10064873, Example 18
SMILES: [H][C@]12CC[C@]3([H])[C@@]4(C)CC[C@H](OC(=O)CC(C)(C)C(O)=O)C(C)(C)[C@]4([H])CC[C@@]3(C)[C@]1(C)CC[C@]1(CC(=O)C(C(C)C)=C21)[C@@H](O)CN(CCN(C)C)Cc1ccc(Cl)cc1
InChI Key: InChIKey=MEOWKUXNVNJAMY-UHFFFAOYSA-N
Data: 2 EC50
| Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Envelope glycoprotein gp160 (Human immunodeficiency virus type 1) | BDBM271401![]() (4- {[(1R,2R,5R,10S,13R,14R, 17S,19R)-5-[(1R)-2- {[...) | GoogleScholar | UniChem | n/a | n/a | n/a | n/a | 0.800 | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Envelope glycoprotein gp160 [V370A] (Human immunodeficiency virus type 1) | BDBM271401![]() (4- {[(1R,2R,5R,10S,13R,14R, 17S,19R)-5-[(1R)-2- {[...) | GoogleScholar | UniChem | n/a | n/a | n/a | n/a | 0.700 | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||