Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LG47VP
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| Ligand Name |
(2S)-1-(4,4-dimethylpiperidin-1-yl)-3-{3-[3-({[(4-fluorophenyl)methyl]amino}methyl)-4-(trifluoromethyl)phenyl]-5-(methylsulfonyl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-1-yl}propan-2-ol
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| Synonyms |
(2S)-1-(4,4-dimethylpiperidin-1-yl)-3-{3-[3-({[(4-fluorophenyl)methyl]amino}methyl)-4-(trifluoromethyl)phenyl]-5-(methylsulfonyl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-1-yl}propan-2-ol; BDBM586494; B9S
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| Structure |
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Download2D MOL |
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| Formula |
C32H41F4N5O3S
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| Canonical SMILES |
CC1(CCN(CC1)CC(CN2C3=C(CN(CC3)S(=O)(=O)C)C(=N2)C4=CC(=C(C=C4)C(F)(F)F)CNCC5=CC=C(C=C5)F)O)C
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| InChI |
1S/C32H41F4N5O3S/c1-31(2)11-14-39(15-12-31)19-26(42)20-41-29-10-13-40(45(3,43)44)21-27(29)30(38-41)23-6-9-28(32(34,35)36)24(16-23)18-37-17-22-4-7-25(33)8-5-22/h4-9,16,26,37,42H,10-15,17-21H2,1-3H3/t26-/m0/s1
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| InChIKey |
QCRLHLMORQICFX-SANMLTNESA-N
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| PubChem Compound ID | ||||
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