General Information of the Compound
| Compound ID |
CP0854269
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| Compound Name |
3-(4-Phenyl-1H-imidazol-2-yl)-1-pyridin-4-yl-2,3,4,9-tetrahydro-1H-beta-carboline
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| Structure |
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| Formula |
C25H21N5
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| Molecular Weight |
391.478
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| Canonical SMILES |
c1ccc(-c2c[nH]c([C@@H]3Cc4c([nH]c5ccccc45)C(c4ccncc4)N3)n2)cc1
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| InChI |
InChI=1S/C25H21N5/c1-2-6-16(7-3-1)22-15-27-25(30-22)21-14-19-18-8-4-5-9-20(18)28-24(19)23(29-21)17-10-12-26-13-11-17/h1-13,15,21,23,28-29H,14H2,(H,27,30)/t21-,23?/m0/s1
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| InChIKey |
MUTDMJWUAKSDSX-BBQAJUCSSA-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