General Information of the Compound
| Compound ID |
CP0549307
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| Compound Name |
N-(2-acetamidoethyl)-N-benzyl-8-ethenyl-1-methyl-4H-chromeno[4,3-c]pyrazole-3-carboxamide
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| Structure |
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| Formula |
C25H26N4O3
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| Molecular Weight |
430.508
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| Canonical SMILES |
CC(=O)NCCN(Cc1ccccc1)C(=O)c1nn(C)c-2c1COc1ccc(C=C)cc-21
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| InChI |
InChI=1S/C25H26N4O3/c1-4-18-10-11-22-20(14-18)24-21(16-32-22)23(27-28(24)3)25(31)29(13-12-26-17(2)30)15-19-8-6-5-7-9-19/h4-11,14H,1,12-13,15-16H2,2-3H3,(H,26,30)
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| InChIKey |
ROHLVDVTZUAMTQ-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