General Information of the Compound
| Compound ID |
CP0416307
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| Compound Name |
(5-chloro-7-methyl-1H-indol-2-yl)-(3-pyrrolidin-1-ylazetidin-1-yl)methanone
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| Structure |
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| Formula |
C17H20ClN3O
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| Molecular Weight |
317.82
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| Canonical SMILES |
Cc1cc(Cl)cc2cc([nH]c12)C(=O)N1CC(C1)N1CCCC1
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| InChI |
InChI=1S/C17H20ClN3O/c1-11-6-13(18)7-12-8-15(19-16(11)12)17(22)21-9-14(10-21)20-4-2-3-5-20/h6-8,14,19H,2-5,9-10H2,1H3
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| InChIKey |
LPPDWWYZIRIPGM-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