General Information of the Compound
| Compound ID |
CP0414313
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| Compound Name |
8-[6-(3,3-dimethylazetidin-1-yl)pyrazin-2-yl]-1,8-diazaspiro[4.5]decan-2-one
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| Structure |
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| Formula |
C17H25N5O
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| Molecular Weight |
315.421
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| Canonical SMILES |
CC1(C)CN(C1)c1cncc(n1)N1CCC2(CCC(=O)N2)CC1
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| InChI |
InChI=1S/C17H25N5O/c1-16(2)11-22(12-16)14-10-18-9-13(19-14)21-7-5-17(6-8-21)4-3-15(23)20-17/h9-10H,3-8,11-12H2,1-2H3,(H,20,23)
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| InChIKey |
WQHOOSNNHNVWQB-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: PT03119, Cytochrome P450 11B1, mitochondrial
Protein ID: PT03120, Cytochrome P450 11B2, mitochondrial