General Information of the Compound
| Compound ID |
CP0426419
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| Compound Name |
CHEMBL4448686
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| Formula |
C24H25N3O4
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| Molecular Weight |
419.481
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| Canonical SMILES |
Oc1c([nH]c(=O)n(Cc2ccccc2)c1=O)C(=O)N[C@H]1CC[C@H](CC1)c1ccccc1
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| InChI |
InChI=1S/C24H25N3O4/c28-21-20(26-24(31)27(23(21)30)15-16-7-3-1-4-8-16)22(29)25-19-13-11-18(12-14-19)17-9-5-2-6-10-17/h1-10,18-19,28H,11-15H2,(H,25,29)(H,26,31)/t18-,19+
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| InChIKey |
VKIYRHLWKIQIFA-KDURUIRLSA-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