General Information of the Compound
| Compound ID |
CP0383823
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| Compound Name |
8-[3,5-bis(trifluoromethyl)benzoyl]-3-[2-(1H-indol-3-yl)ethyl]-1,3,8-triazaspiro[4.5]decane-2,4-dione
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| Structure |
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| Formula |
C26H22F6N4O3
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| Molecular Weight |
552.475
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| Canonical SMILES |
FC(F)(F)c1cc(cc(c1)C(F)(F)F)C(=O)N1CCC2(CC1)NC(=O)N(CCc1c[nH]c3ccccc13)C2=O
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| InChI |
InChI=1S/C26H22F6N4O3/c27-25(28,29)17-11-16(12-18(13-17)26(30,31)32)21(37)35-9-6-24(7-10-35)22(38)36(23(39)34-24)8-5-15-14-33-20-4-2-1-3-19(15)20/h1-4,11-14,33H,5-10H2,(H,34,39)
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| InChIKey |
DGQVOEAFFYHRME-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