General Information of the Compound
| Compound ID |
CP0400556
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| Compound Name |
US8969325, 308
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| Structure |
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| Formula |
C20H22N4O4
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| Molecular Weight |
382.42
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| Canonical SMILES |
OCCN1Cc2ccc(NC(=O)N[C@@H]3CCOc4ccccc34)cc2NC1=O
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| InChI |
InChI=1S/C20H22N4O4/c25-9-8-24-12-13-5-6-14(11-17(13)23-20(24)27)21-19(26)22-16-7-10-28-18-4-2-1-3-15(16)18/h1-6,11,16,25H,7-10,12H2,(H,23,27)(H2,21,22,26)/t16-/m1/s1
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| InChIKey |
ZSVANKMWGWSNOS-MRXNPFEDSA-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