General Information of the Compound
| Compound ID |
CP0564134
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| Compound Name |
2-[2-(cyclopropanecarbonylamino)pyridin-4-yl]-N-[3-[[2-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]oxyacetyl]amino]propyl]-4-methoxy-1,3-thiazole-5-carboxamide
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| Formula |
C32H31N7O9S
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| Molecular Weight |
689.707
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| Canonical SMILES |
COc1nc(sc1C(=O)NCCCNC(=O)COc1cccc2C(=O)N(C3CCC(=O)NC3=O)C(=O)c12)-c1ccnc(NC(=O)C2CC2)c1
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| InChI |
InChI=1S/C32H31N7O9S/c1-47-29-25(49-30(38-29)17-10-13-33-21(14-17)36-26(42)16-6-7-16)28(44)35-12-3-11-34-23(41)15-48-20-5-2-4-18-24(20)32(46)39(31(18)45)19-8-9-22(40)37-27(19)43/h2,4-5,10,13-14,16,19H,3,6-9,11-12,15H2,1H3,(H,34,41)(H,35,44)(H,33,36,42)(H,37,40,43)
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| InChIKey |
PQOGPNUZXPYUHE-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