General Information of the Compound
| Compound ID |
CP0396036
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| Compound Name |
(E)-N-(4-methylpiperazin-1-yl)-1-(1-naphthalen-1-ylsulfonyl-2-phenylindol-3-yl)methanimine
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| Structure |
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| Formula |
C30H28N4O2S
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| Molecular Weight |
508.647
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| Canonical SMILES |
CN1CCN(CC1)\N=C\c1c(-c2ccccc2)n(c2ccccc12)S(=O)(=O)c1cccc2ccccc12
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| InChI |
InChI=1S/C30H28N4O2S/c1-32-18-20-33(21-19-32)31-22-27-26-15-7-8-16-28(26)34(30(27)24-11-3-2-4-12-24)37(35,36)29-17-9-13-23-10-5-6-14-25(23)29/h2-17,22H,18-21H2,1H3/b31-22+
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| InChIKey |
SUMCZJCAGCXOIF-DFKUXCBWSA-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