General Information of the Compound
| Compound ID |
CP0564752
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| Compound Name |
N-[[2,4-dichloro-3-(4-methoxy-3-propan-2-ylphenoxy)phenyl]methyl]-1-sulfamoylazetidine-3-carboxamide
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| Formula |
C21H25Cl2N3O5S
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| Molecular Weight |
502.42
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| Canonical SMILES |
COc1ccc(Oc2c(Cl)ccc(CNC(=O)C3CN(C3)S(N)(=O)=O)c2Cl)cc1C(C)C
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| InChI |
InChI=1S/C21H25Cl2N3O5S/c1-12(2)16-8-15(5-7-18(16)30-3)31-20-17(22)6-4-13(19(20)23)9-25-21(27)14-10-26(11-14)32(24,28)29/h4-8,12,14H,9-11H2,1-3H3,(H,25,27)(H2,24,28,29)
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| InChIKey |
FOECKCYOBGEIRW-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