Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L35YRN
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| Ligand Name |
Lrrk2-IN-3
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| Synonyms |
LRRK2-IN-3; (3R,4R)-4-{4-[6-chloro-2-({1-[(1R)-2,2-difluorocyclopropyl]-5-methyl-1H-pyrazol-4-yl}amino)quinazolin-7-yl]piperidin-1-yl}-4-methyloxolan-3-ol; HY-145318; CS-0371208; BYL
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| Structure |
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Download2D MOL |
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| Formula |
C25H29ClF2N6O2
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| Canonical SMILES |
CC1=C(C=NN1C2CC2(F)F)NC3=NC4=CC(=C(C=C4C=N3)Cl)C5CCN(CC5)C6(COCC6O)C
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| InChI |
1S/C25H29ClF2N6O2/c1-14-20(11-30-34(14)21-9-25(21,27)28)32-23-29-10-16-7-18(26)17(8-19(16)31-23)15-3-5-33(6-4-15)24(2)13-36-12-22(24)35/h7-8,10-11,15,21-22,35H,3-6,9,12-13H2,1-2H3,(H,29,31,32)/t21-,22+,24-/m1/s1
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| InChIKey |
VFCYOTBJVABSBY-AOHZBQACSA-N
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| PubChem Compound ID | ||||
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