General Information of the Compound
| Compound ID |
CP0400401
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| Compound Name |
6-[2-[4-(4-methylpiperazin-1-yl)phenyl]-5-pyridin-4-yl-1H-imidazol-4-yl]-1,4-dihydroindeno[1,2-c]pyrazole
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| Structure |
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| Formula |
C29H27N7
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| Molecular Weight |
473.584
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| Canonical SMILES |
CN1CCN(CC1)c1ccc(cc1)-c1nc(c([nH]1)-c1ccncc1)-c1ccc-2c(Cc3cn[nH]c-23)c1
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| InChI |
InChI=1S/C29H27N7/c1-35-12-14-36(15-13-35)24-5-2-20(3-6-24)29-32-27(19-8-10-30-11-9-19)28(33-29)21-4-7-25-22(16-21)17-23-18-31-34-26(23)25/h2-11,16,18H,12-15,17H2,1H3,(H,31,34)(H,32,33)
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| InChIKey |
WKFRHTGMVITXBX-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