General Information of the Compound
| Compound ID |
CP0429472
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| Compound Name |
2-chloro-N-(2,6-dimethylphenyl)-N-(2-morpholino-2-(4-nitrophenyl)acetyl)benzamide
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| Structure |
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| Formula |
C27H26ClN3O5
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| Molecular Weight |
507.974
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| Canonical SMILES |
Cc1cccc(C)c1N(C(=O)C(N1CCOCC1)c1ccc(cc1)[N+]([O-])=O)C(=O)c1ccccc1Cl
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| InChI |
InChI=1S/C27H26ClN3O5/c1-18-6-5-7-19(2)24(18)30(26(32)22-8-3-4-9-23(22)28)27(33)25(29-14-16-36-17-15-29)20-10-12-21(13-11-20)31(34)35/h3-13,25H,14-17H2,1-2H3
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| InChIKey |
LRWQOJYFZBJAOO-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