General Information of the Compound
| Compound ID |
CP0450614
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| Compound Name |
4-chloro-N-[(1R)-1-(1-ethyl-5-morpholin-4-ylbenzimidazol-2-yl)ethyl]benzenesulfonamide
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| Structure |
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| Formula |
C21H25ClN4O3S
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| Molecular Weight |
448.976
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| Canonical SMILES |
CCn1c(nc2cc(ccc12)N1CCOCC1)[C@@H](C)NS(=O)(=O)c1ccc(Cl)cc1
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| InChI |
InChI=1S/C21H25ClN4O3S/c1-3-26-20-9-6-17(25-10-12-29-13-11-25)14-19(20)23-21(26)15(2)24-30(27,28)18-7-4-16(22)5-8-18/h4-9,14-15,24H,3,10-13H2,1-2H3/t15-/m1/s1
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| InChIKey |
RHPFHNFTPUBQQQ-OAHLLOKOSA-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