General Information of the Compound
| Compound ID |
CP0153778
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| Compound Name |
methyl (5R)-5-(2-chloro-4-cyanophenyl)-6,7-dihydropyrrolo[1,2-c]imidazole-5-carboxylate
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| Structure |
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| Formula |
C15H12ClN3O2
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| Molecular Weight |
301.733
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| Canonical SMILES |
COC(=O)[C@@]1(CCc2cncn12)c1ccc(cc1Cl)C#N
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| InChI |
InChI=1S/C15H12ClN3O2/c1-21-14(20)15(5-4-11-8-18-9-19(11)15)12-3-2-10(7-17)6-13(12)16/h2-3,6,8-9H,4-5H2,1H3/t15-/m1/s1
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| InChIKey |
OYOXKESECMPXNQ-OAHLLOKOSA-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