General Information of the Compound
| Compound ID |
CP0481977
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| Compound Name |
2-[3-[[2-[hydroxy(phenyl)methyl]phenyl]methyl]-2-methyl-4-oxo-6,7-dihydro-5H-pyrrolo[3,2-c]pyridin-1-yl]acetic acid
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| Structure |
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| Formula |
C24H24N2O4
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| Molecular Weight |
404.466
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| Canonical SMILES |
Cc1c(Cc2ccccc2C(O)c2ccccc2)c2c(CCNC2=O)n1CC(O)=O
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| InChI |
InChI=1S/C24H24N2O4/c1-15-19(22-20(11-12-25-24(22)30)26(15)14-21(27)28)13-17-9-5-6-10-18(17)23(29)16-7-3-2-4-8-16/h2-10,23,29H,11-14H2,1H3,(H,25,30)(H,27,28)
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| InChIKey |
HDVBEDMMBCIRJM-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