General Information of the Compound
| Compound ID |
CP0397534
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| Compound Name |
(E)-1-[1-(4-fluorophenyl)sulfonyl-2-phenylindol-3-yl]-N-(4-methylpiperazin-1-yl)methanimine
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| Structure |
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| Formula |
C26H25FN4O2S
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| Molecular Weight |
476.577
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| Canonical SMILES |
CN1CCN(CC1)\N=C\c1c(-c2ccccc2)n(c2ccccc12)S(=O)(=O)c1ccc(F)cc1
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| InChI |
InChI=1S/C26H25FN4O2S/c1-29-15-17-30(18-16-29)28-19-24-23-9-5-6-10-25(23)31(26(24)20-7-3-2-4-8-20)34(32,33)22-13-11-21(27)12-14-22/h2-14,19H,15-18H2,1H3/b28-19+
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| InChIKey |
BPURISIIOQRMLB-TURZUDJPSA-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