General Information of the Compound
| Compound ID |
CP0569961
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| Compound Name |
1-cyclopropyl-3-[[1-(4-hydroxybutyl)pyrrolo[2,3-c]pyridin-2-yl]methyl]imidazo[4,5-c]pyridin-2-one
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| Structure |
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| Formula |
C21H23N5O2
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| Molecular Weight |
377.448
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| Canonical SMILES |
OCCCCn1c(Cn2c3cnccc3n(C3CC3)c2=O)cc2ccncc12
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| InChI |
InChI=1S/C21H23N5O2/c27-10-2-1-9-24-17(11-15-5-7-22-12-19(15)24)14-25-20-13-23-8-6-18(20)26(21(25)28)16-3-4-16/h5-8,11-13,16,27H,1-4,9-10,14H2
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| InChIKey |
ROXMYRJLBPXANS-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