General Information of the Compound
| Compound ID |
CP0558175
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| Compound Name |
CHEMBL4439493
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| Formula |
C26H26N2O5
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| Molecular Weight |
446.503
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| Canonical SMILES |
CCC(CC)C1N(C(=O)C(O)=C1C(=O)c1ccc(OC)cc1)c1ccc(cc1)-c1ccon1
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| InChI |
InChI=1S/C26H26N2O5/c1-4-16(5-2)23-22(24(29)18-8-12-20(32-3)13-9-18)25(30)26(31)28(23)19-10-6-17(7-11-19)21-14-15-33-27-21/h6-16,23,30H,4-5H2,1-3H3
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| InChIKey |
OSYJTEVIPYRGNR-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