General Information of the Compound
| Compound ID |
CP0520950
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| Compound Name |
2-(3-(4-chlorobenzyl)-2-imino-2,3-dihydro-1H-benzo[d]imidazol-1-yl)ethanol
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| Structure |
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| Formula |
C16H16ClN3O
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| Molecular Weight |
301.777
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| Canonical SMILES |
OCCn1c2ccccc2n(Cc2ccc(Cl)cc2)c1=N
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| InChI |
InChI=1S/C16H16ClN3O/c17-13-7-5-12(6-8-13)11-20-15-4-2-1-3-14(15)19(9-10-21)16(20)18/h1-8,18,21H,9-11H2
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| InChIKey |
BDBJVOWIFIUXCB-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