General Information of the Compound
| Compound ID |
CP0505321
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| Compound Name |
2-(4-chloro-2-methoxyphenyl)-5-(1-(2-(pyrrolidin-1-yl)ethyl)-1H-indazol-5-yl)furo[3,2-c]pyridin-4(5H)-one
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| Structure |
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| Formula |
C27H25ClN4O3
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| Molecular Weight |
488.975
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| Canonical SMILES |
COc1cc(Cl)ccc1-c1cc2c(ccn(-c3ccc4n(CCN5CCCC5)ncc4c3)c2=O)o1
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| InChI |
InChI=1S/C27H25ClN4O3/c1-34-25-15-19(28)4-6-21(25)26-16-22-24(35-26)8-11-31(27(22)33)20-5-7-23-18(14-20)17-29-32(23)13-12-30-9-2-3-10-30/h4-8,11,14-17H,2-3,9-10,12-13H2,1H3
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| InChIKey |
RUVBWCIMLGJSCP-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