General Information of the Compound
| Compound ID |
CP0549534
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| Compound Name |
(NZ)-N-[4-[4-(5-chloropyridin-2-yl)-1,4-diazepan-1-yl]-1-(4-fluorophenyl)butylidene]hydroxylamine
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| Structure |
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| Formula |
C20H24ClFN4O
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| Molecular Weight |
390.89
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| Canonical SMILES |
O\N=C(\CCCN1CCCN(CC1)c1ccc(Cl)cn1)c1ccc(F)cc1
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| InChI |
InChI=1S/C20H24ClFN4O/c21-17-6-9-20(23-15-17)26-12-2-11-25(13-14-26)10-1-3-19(24-27)16-4-7-18(22)8-5-16/h4-9,15,27H,1-3,10-14H2/b24-19-
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| InChIKey |
VCXAHILCUQVCRK-CLCOLTQESA-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