General Information of the Compound
| Compound ID |
CP0914643
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| Compound Name |
3-(1-oxo-5-(((R)-1-(4-(piperidin-1-yl)benzyl)piperidin-2-yl)methoxy)isoindolin-2-yl)piperidine-2,6-dione
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| Structure |
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| Formula |
C31H38N4O4
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| Molecular Weight |
530.669
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| Canonical SMILES |
O=C1CCC(N2Cc3cc(OC[C@H]4CCCCN4Cc4ccc(N5CCCCC5)cc4)ccc3C2=O)C(=O)N1
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| InChI |
InChI=1S/C31H38N4O4/c36-29-14-13-28(30(37)32-29)35-20-23-18-26(11-12-27(23)31(35)38)39-21-25-6-2-5-17-34(25)19-22-7-9-24(10-8-22)33-15-3-1-4-16-33/h7-12,18,25,28H,1-6,13-17,19-21H2,(H,32,36,37)/t25-,28?/m1/s1
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| InChIKey |
YMHQRQIVWNGUMS-RXVAYIKUSA-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