General Information of the Compound
| Compound ID |
CP0772308
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| Compound Name |
N-(2,6-dimethylphenyl)-5-[5-(4-methylpiperazin-1-ylmethyl)thiophen-2-yl]imidazo[1,5-a]pyrazin-8-amine hydrochloride
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| Structure |
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| Formula |
C23H26ClN5S
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| Molecular Weight |
440.016
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| Canonical SMILES |
Cc1cccc(C)c1Nc1ncc(-c2ccc(CN3CCCC3)s2)n2cncc12.Cl
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| InChI |
InChI=1S/C23H25N5S.ClH/c1-16-6-5-7-17(2)22(16)26-23-20-12-24-15-28(20)19(13-25-23)21-9-8-18(29-21)14-27-10-3-4-11-27;/h5-9,12-13,15H,3-4,10-11,14H2,1-2H3,(H,25,26);1H
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| InChIKey |
VHODWRUYCQKVLT-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