General Information of the Compound
| Compound ID |
CP0527415
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| Compound Name |
(2R)-3-(4-chlorophenyl)-2-[[2-(4-chlorophenyl)acetyl]amino]-N-[3-(dimethylamino)propyl]propanamide
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| Structure |
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| Formula |
C22H27Cl2N3O2
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| Molecular Weight |
436.383
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| Canonical SMILES |
CN(C)CCCNC(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)Cc1ccc(Cl)cc1
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| InChI |
InChI=1S/C22H27Cl2N3O2/c1-27(2)13-3-12-25-22(29)20(14-16-4-8-18(23)9-5-16)26-21(28)15-17-6-10-19(24)11-7-17/h4-11,20H,3,12-15H2,1-2H3,(H,25,29)(H,26,28)/t20-/m1/s1
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| InChIKey |
MECCMAZCQYVXEK-HXUWFJFHSA-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