General Information of the Compound
| Compound ID |
CP0570830
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| Compound Name |
4-[5-chloro-2-[(1-cyclopropyl-2-oxoimidazo[4,5-c]pyridin-3-yl)methyl]indol-1-yl]butanoic acid
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| Structure |
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| Formula |
C22H21ClN4O3
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| Molecular Weight |
424.888
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| Canonical SMILES |
OC(=O)CCCn1c(Cn2c3cnccc3n(C3CC3)c2=O)cc2cc(Cl)ccc12
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| InChI |
InChI=1S/C22H21ClN4O3/c23-15-3-6-18-14(10-15)11-17(25(18)9-1-2-21(28)29)13-26-20-12-24-8-7-19(20)27(22(26)30)16-4-5-16/h3,6-8,10-12,16H,1-2,4-5,9,13H2,(H,28,29)
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| InChIKey |
IELCICNATLZYTD-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