General Information of the Compound
| Compound ID |
CP0515512
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| Compound Name |
4-[2-(pyrrolo[2,3-c]pyridin-1-ylmethyl)benzimidazol-1-yl]butan-1-ol
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| Structure |
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| Formula |
C19H20N4O
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| Molecular Weight |
320.396
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| Canonical SMILES |
OCCCCn1c(Cn2ccc3ccncc23)nc2ccccc12
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| InChI |
InChI=1S/C19H20N4O/c24-12-4-3-10-23-17-6-2-1-5-16(17)21-19(23)14-22-11-8-15-7-9-20-13-18(15)22/h1-2,5-9,11,13,24H,3-4,10,12,14H2
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| InChIKey |
NRUBHLFCAVOGLO-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