General Information of the Compound
| Compound ID |
CP0281206
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| Compound Name |
(+/-)-N-(3-(5-fluoro-1H-indol-3-yl)propyl)-N-(1-oxo-1,2,3,7,8,9-hexahydropyrano[3,2-e]isoindol-8-yl)benzamide
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| Structure |
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| Formula |
C29H26FN3O3
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| Molecular Weight |
483.543
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| Canonical SMILES |
Fc1ccc2[nH]cc(CCCN(C3COc4ccc5CNC(=O)c5c4C3)C(=O)c3ccccc3)c2c1
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| InChI |
InChI=1S/C29H26FN3O3/c30-21-9-10-25-23(13-21)19(15-31-25)7-4-12-33(29(35)18-5-2-1-3-6-18)22-14-24-26(36-17-22)11-8-20-16-32-28(34)27(20)24/h1-3,5-6,8-11,13,15,22,31H,4,7,12,14,16-17H2,(H,32,34)
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| InChIKey |
DSNDRFNBUJSXEM-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