General Information of the Compound
| Compound ID |
CP0455866
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| Compound Name |
1-[4-[3-(5-fluoro-1H-indol-3-yl)piperidin-1-yl]butyl]-3-(1H-indol-3-yl)pyrrolidine-2,5-dione
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| Structure |
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| Formula |
C29H31FN4O2
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| Molecular Weight |
486.591
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| Canonical SMILES |
Fc1ccc2[nH]cc(C3CCCN(CCCCN4C(=O)CC(C4=O)c4c[nH]c5ccccc45)C3)c2c1
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| InChI |
InChI=1S/C29H31FN4O2/c30-20-9-10-27-22(14-20)24(16-31-27)19-6-5-12-33(18-19)11-3-4-13-34-28(35)15-23(29(34)36)25-17-32-26-8-2-1-7-21(25)26/h1-2,7-10,14,16-17,19,23,31-32H,3-6,11-13,15,18H2
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| InChIKey |
MHYBKGVFXMFFRT-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