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BDBM50328439 (1S,3R)-N-(3-(4-methyl-5-(4-methyloxazol-5-yl)-4H-1,2,4-triazol-3-ylthio)propyl)-1-(4-(trifluoromethyl)phenyl)bicyclo[3.1.0]hexan-3-amine::(2R,5S)-N-(3-(4-methyl-5-(4-methyloxazol-5-yl)-4H-1,2,4-triazol-3-ylthio)propyl)-5-(4-(trifluoromethyl)phenyl)bicyclo[3.1.0]hexan-2-amine::CHEMBL1258035
SMILES: Cc1ncoc1-c1nnc(SCCCN[C@@H]2CC[C@@]3(CC23)c2ccc(cc2)C(F)(F)F)n1C
InChI Key: InChIKey=VTGDLGOSPAKXEA-UHFFFAOYSA-N
Data: 7 IC50
| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Cytochrome P450 1A2 (Human) | BDBM50328439![]() ((1S,3R)-N-(3-(4-methyl-5-(4-methyloxazol-5-yl)-4H-...) | GoogleScholar | UniChem | n/a | n/a | >4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | |
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| More data for this Ligand-Target Pair | |||||||||||||
| Cytochrome P450 2C9 (Human) | BDBM50328439![]() ((1S,3R)-N-(3-(4-methyl-5-(4-methyloxazol-5-yl)-4H-...) | GoogleScholar | UniChem | n/a | n/a | >4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Cytochrome P450 2C19 (Human) | BDBM50328439![]() ((1S,3R)-N-(3-(4-methyl-5-(4-methyloxazol-5-yl)-4H-...) | GoogleScholar | UniChem | n/a | n/a | >4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Cytochrome P450 2D6 (Human) | BDBM50328439![]() ((1S,3R)-N-(3-(4-methyl-5-(4-methyloxazol-5-yl)-4H-...) | GoogleScholar | UniChem | n/a | n/a | >4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Cytochrome P450 3A4 (Human) | BDBM50328439![]() ((1S,3R)-N-(3-(4-methyl-5-(4-methyloxazol-5-yl)-4H-...) | GoogleScholar | UniChem | n/a | n/a | >4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Potassium voltage-gated channel subfamily H member 2 (Human) | BDBM50328439![]() ((1S,3R)-N-(3-(4-methyl-5-(4-methyloxazol-5-yl)-4H-...) | GoogleScholar | UniChem | n/a | n/a | 251 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Potassium voltage-gated channel subfamily H member 2 (Human) | BDBM50328439![]() ((1S,3R)-N-(3-(4-methyl-5-(4-methyloxazol-5-yl)-4H-...) | GoogleScholar | UniChem | n/a | n/a | 251 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||