General Information of the Compound
| Compound ID |
CP0922717
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| Compound Name |
Dimethyl-{4-[3-(4-phenyl-1H-imidazol-2-yl)-2,3,4,9-tetrahydro-1H-beta-carbolin-1-yl]-phenyl}-amine
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| Structure |
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| Formula |
C28H27N5
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| Molecular Weight |
433.559
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| Canonical SMILES |
CN(C)c1ccc(C2N[C@H](c3nc(-c4ccccc4)c[nH]3)Cc3c2[nH]c2ccccc32)cc1
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| InChI |
InChI=1S/C28H27N5/c1-33(2)20-14-12-19(13-15-20)26-27-22(21-10-6-7-11-23(21)30-27)16-24(31-26)28-29-17-25(32-28)18-8-4-3-5-9-18/h3-15,17,24,26,30-31H,16H2,1-2H3,(H,29,32)/t24-,26?/m0/s1
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| InChIKey |
CFPAEAOCFWPJMN-QSAPEBAKSA-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