General Information of the Compound
| Compound ID |
CP0897293
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| Compound Name |
1-(7-Benzyl-2-methyl-5H-pyrrolo[3,2-d]pyrimidin-4-yl)-6-methoxy-1,2,3,4-tetrahydroquinoline hydrochloride
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| Structure |
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| Formula |
C24H25ClN4O
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| Molecular Weight |
420.944
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| Canonical SMILES |
COc1ccc2c(c1)CCCN2c1nc(C)nc2c(Cc3ccccc3)c[nH]c12.Cl
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| InChI |
InChI=1S/C24H24N4O.ClH/c1-16-26-22-19(13-17-7-4-3-5-8-17)15-25-23(22)24(27-16)28-12-6-9-18-14-20(29-2)10-11-21(18)28;/h3-5,7-8,10-11,14-15,25H,6,9,12-13H2,1-2H3;1H
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| InChIKey |
IWBJHNJQODGGSH-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: PT00922, Epidermal growth factor receptor
Protein ID: PT00844, Platelet-derived growth factor receptor beta
Protein ID: PT00864, Vascular endothelial growth factor receptor 2
Cell Viability or Cytotoxicity Assay