General Information of the Compound
| Compound ID |
CP0862890
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| Compound Name |
1,1-Diethyl-3-(4-phenyl-1H-imidazol-2-yl)-2,3,4,9-tetrahydro-1H-beta-carboline
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| Structure |
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| Formula |
C24H26N4
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| Molecular Weight |
370.5
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| Canonical SMILES |
CCC1(CC)N[C@H](c2nc(-c3ccccc3)c[nH]2)Cc2c1[nH]c1ccccc21
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| InChI |
InChI=1S/C24H26N4/c1-3-24(4-2)22-18(17-12-8-9-13-19(17)26-22)14-20(28-24)23-25-15-21(27-23)16-10-6-5-7-11-16/h5-13,15,20,26,28H,3-4,14H2,1-2H3,(H,25,27)/t20-/m0/s1
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| InChIKey |
DXRCEZLHQFJEED-FQEVSTJZSA-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