General Information of the Compound
| Compound ID |
CP0384181
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| Compound Name |
8-Cyano-1-(2-methoxy-benzyl)-7-(4-methoxy-phenyl)-6-{[methyl-(2-pyridin-2-yl-ethyl)-amino]-methyl}-4-oxo-1,4-dihydro-pyrrolo[1,2-a]pyrimidine-3-carboxylic acid ethyl ester
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| Structure |
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| Formula |
C35H35N5O5
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| Molecular Weight |
605.695
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| Canonical SMILES |
CCOC(=O)c1cn(Cc2ccccc2OC)c2c(C#N)c(c(CN(C)CCc3ccccn3)n2c1=O)-c1ccc(OC)cc1
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| InChI |
InChI=1S/C35H35N5O5/c1-5-45-35(42)29-22-39(21-25-10-6-7-12-31(25)44-4)33-28(20-36)32(24-13-15-27(43-3)16-14-24)30(40(33)34(29)41)23-38(2)19-17-26-11-8-9-18-37-26/h6-16,18,22H,5,17,19,21,23H2,1-4H3
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| InChIKey |
PSMWETCHLLHYKZ-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