General Information of the Compound
| Compound ID |
CP0456086
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| Compound Name |
9-chloro-1-(2,4-dichlorophenyl)-6-(1-imidazol-1-ylpropyl)-3,4-dihydro-2H-pyrimido[1,2-a]benzimidazole
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| Structure |
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| Formula |
C22H20Cl3N5
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| Molecular Weight |
460.796
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| Canonical SMILES |
CCC(c1ccc(Cl)c2nc3N(CCCn3c12)c1ccc(Cl)cc1Cl)n1ccnc1
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| InChI |
InChI=1S/C22H20Cl3N5/c1-2-18(28-11-8-26-13-28)15-5-6-16(24)20-21(15)30-10-3-9-29(22(30)27-20)19-7-4-14(23)12-17(19)25/h4-8,11-13,18H,2-3,9-10H2,1H3
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| InChIKey |
MUMWOVRXFJCTOX-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