General Information of the Compound
| Compound ID |
CP0432398
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| Compound Name |
4-[8-(7-methyl-1H-indazole-5-carbonyl)-3-oxo-2,8-diazaspiro[4.5]decan-2-yl]benzoic acid
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| Structure |
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| Formula |
C24H24N4O4
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| Molecular Weight |
432.48
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| Canonical SMILES |
Cc1cc(cc2cn[nH]c12)C(=O)N1CCC2(CN(C(=O)C2)c2ccc(cc2)C(O)=O)CC1
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| InChI |
InChI=1S/C24H24N4O4/c1-15-10-17(11-18-13-25-26-21(15)18)22(30)27-8-6-24(7-9-27)12-20(29)28(14-24)19-4-2-16(3-5-19)23(31)32/h2-5,10-11,13H,6-9,12,14H2,1H3,(H,25,26)(H,31,32)
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| InChIKey |
CECVWUCPRKIPOZ-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
Protein ID: PT01270, Acetyl-CoA carboxylase 1
Protein ID: PT01119, Acetyl-CoA carboxylase 2