General Information of the Compound
| Compound ID |
CP0129579
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| Compound Name |
(5S)-3-(4-azidophenyl)-1-benzyl-5-methylimidazolidine-2,4-dione
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| Structure |
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| Formula |
C17H15N5O2
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| Molecular Weight |
321.34
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| Canonical SMILES |
C[C@@H]1N(Cc2ccccc2)C(=O)N(C1=O)c1ccc(cc1)N=[N+]=[N-]
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| InChI |
InChI=1S/C17H15N5O2/c1-12-16(23)22(15-9-7-14(8-10-15)19-20-18)17(24)21(12)11-13-5-3-2-4-6-13/h2-10,12H,11H2,1H3/t12-/m0/s1
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| InChIKey |
YRXQKGLBTVAKSC-LBPRGKRZSA-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: PT02397, Protein smoothened
Protein ID: PT04361, Protein smoothened