General Information of the Compound
| Compound ID |
CP0573220
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| Compound Name |
2-[[4-[[2-[4-(4,5-dihydro-1H-imidazol-2-yl)anilino]-2-oxoethyl]carbamoylamino]phenyl]carbamoylamino]-N-[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]acetamide
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| Structure |
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| Formula |
C30H32N10O4
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| Molecular Weight |
596.652
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| Canonical SMILES |
O=C(CNC(=O)Nc1ccc(NC(=O)NCC(=O)Nc2ccc(cc2)C2=NCCN2)cc1)Nc1ccc(cc1)C1=NCCN1
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| InChI |
InChI=1S/C30H32N10O4/c41-25(37-21-5-1-19(2-6-21)27-31-13-14-32-27)17-35-29(43)39-23-9-11-24(12-10-23)40-30(44)36-18-26(42)38-22-7-3-20(4-8-22)28-33-15-16-34-28/h1-12H,13-18H2,(H,31,32)(H,33,34)(H,37,41)(H,38,42)(H2,35,39,43)(H2,36,40,44)
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| InChIKey |
PZRLCRMZASNWID-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