General Information of the Compound
| Compound ID |
CP0556528
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| Compound Name |
US8969325, 288
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| Structure |
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| Formula |
C24H27N3O3
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| Molecular Weight |
405.498
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| Canonical SMILES |
CN1C(=O)CCc2ccc(NC(=O)N[C@@H]3CC4(CCCC4)Oc4ccccc34)cc12
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| InChI |
InChI=1S/C24H27N3O3/c1-27-20-14-17(10-8-16(20)9-11-22(27)28)25-23(29)26-19-15-24(12-4-5-13-24)30-21-7-3-2-6-18(19)21/h2-3,6-8,10,14,19H,4-5,9,11-13,15H2,1H3,(H2,25,26,29)/t19-/m1/s1
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| InChIKey |
FKVKACCOVDVJAP-LJQANCHMSA-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