General Information of the Compound
| Compound ID |
CP0260464
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| Compound Name |
CHEMBL2178938
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| Formula |
C23H28N4O4
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| Molecular Weight |
424.501
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| Canonical SMILES |
CC(C)(NC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)-c1cncc(n1)C(N)=O)C(O)=O
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| InChI |
InChI=1S/C23H28N4O4/c1-23(2,22(30)31)27-20(28)11-14-3-5-15(6-4-14)16-7-9-17(10-8-16)18-12-25-13-19(26-18)21(24)29/h7-10,12-15H,3-6,11H2,1-2H3,(H2,24,29)(H,27,28)(H,30,31)/t14-,15-
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| InChIKey |
CIJJTONMLUUZEV-SHTZXODSSA-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