General Information of the Compound
| Compound ID |
CP0503674
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| Compound Name |
US8637507, C-1
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| Structure |
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| Formula |
C26H27N3O5
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| Molecular Weight |
461.518
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| Canonical SMILES |
CC1CN(C(=O)Nc2ccccc2)c2ccc(cc2O1)-c1ccc(OCC(C)(C)C(O)=O)nc1
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| InChI |
InChI=1S/C26H27N3O5/c1-17-15-29(25(32)28-20-7-5-4-6-8-20)21-11-9-18(13-22(21)34-17)19-10-12-23(27-14-19)33-16-26(2,3)24(30)31/h4-14,17H,15-16H2,1-3H3,(H,28,32)(H,30,31)
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| InChIKey |
OLROHKZBJJCTOP-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