General Information of the Compound
| Compound ID |
CP0511278
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| Compound Name |
8-[3-[3-(3,4-dichlorophenyl)-1-(furan-2-carbonyl)pyrrolidin-3-yl]propyl]-1-phenyl-1,3,8-triazaspiro[4.5]decane-2,4-dione
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| Structure |
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| Formula |
C31H32Cl2N4O4
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| Molecular Weight |
595.527
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| Canonical SMILES |
Clc1ccc(cc1Cl)C1(CCCN2CCC3(CC2)N(C(=O)NC3=O)c2ccccc2)CCN(C1)C(=O)c1ccco1
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| InChI |
InChI=1S/C31H32Cl2N4O4/c32-24-10-9-22(20-25(24)33)30(12-18-36(21-30)27(38)26-8-4-19-41-26)11-5-15-35-16-13-31(14-17-35)28(39)34-29(40)37(31)23-6-2-1-3-7-23/h1-4,6-10,19-20H,5,11-18,21H2,(H,34,39,40)
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| InChIKey |
PNJPLGNSXKMNDR-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