General Information of the Compound
| Compound ID |
CP0423222
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| Compound Name |
2-((R)-1-(3,4-dichlorophenylsulfonyl)-3-oxo-1,2,3,4-tetrahydroquinoxalin-2-yl)-N-((R)-7-formylchroman-4-yl)acetamide
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| Structure |
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| Formula |
C26H21Cl2N3O6S
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| Molecular Weight |
574.442
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| Canonical SMILES |
Clc1ccc(cc1Cl)S(=O)(=O)N1[C@H](CC(=O)N[C@@H]2CCOc3cc(C=O)ccc23)C(=O)Nc2ccccc12
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| InChI |
InChI=1S/C26H21Cl2N3O6S/c27-18-8-6-16(12-19(18)28)38(35,36)31-22-4-2-1-3-21(22)30-26(34)23(31)13-25(33)29-20-9-10-37-24-11-15(14-32)5-7-17(20)24/h1-8,11-12,14,20,23H,9-10,13H2,(H,29,33)(H,30,34)/t20-,23-/m1/s1
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| InChIKey |
RTKTTWJHMINNBF-NFBKMPQASA-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