General Information of the Compound
| Compound ID |
CP0437635
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| Compound Name |
(2S,4E)-N-[(2,4-dichlorophenyl)methyl]-4-(morpholin-4-ylmethylidene)-5-oxopyrrolidine-2-carboxamide
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| Structure |
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| Formula |
C17H19Cl2N3O3
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| Molecular Weight |
384.263
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| Canonical SMILES |
Clc1ccc(CNC(=O)[C@@H]2C\C(=C/N3CCOCC3)C(=O)N2)c(Cl)c1
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| InChI |
InChI=1S/C17H19Cl2N3O3/c18-13-2-1-11(14(19)8-13)9-20-17(24)15-7-12(16(23)21-15)10-22-3-5-25-6-4-22/h1-2,8,10,15H,3-7,9H2,(H,20,24)(H,21,23)/b12-10+/t15-/m0/s1
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| InChIKey |
KEODEZBMFGQVDQ-PABFRNLHSA-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