General Information of the Compound
| Compound ID |
CP0557965
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| Compound Name |
5-[[2-fluoro-4-(2-methylindazol-5-yl)phenyl]methyl]-4H-pyrrolo[3,4-d][1,3]thiazol-6-one
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| Structure |
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| Formula |
C20H15FN4OS
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| Molecular Weight |
378.432
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| Canonical SMILES |
Cn1cc2cc(ccc2n1)-c1ccc(CN2Cc3ncsc3C2=O)c(F)c1
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| InChI |
InChI=1S/C20H15FN4OS/c1-24-8-15-6-12(4-5-17(15)23-24)13-2-3-14(16(21)7-13)9-25-10-18-19(20(25)26)27-11-22-18/h2-8,11H,9-10H2,1H3
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| InChIKey |
XFZVUORXFGXXCR-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound
Protein ID: PT07317, Complement decay-accelerating factor
Protein ID: PT01310, Muscarinic acetylcholine receptor M1
Protein ID: PT01198, Muscarinic acetylcholine receptor M2
Protein ID: PT01266, Muscarinic acetylcholine receptor M3
Protein ID: PT01516, Muscarinic acetylcholine receptor M5