Drug Information
Drug General Information | Top | |||
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Drug ID |
D01RHR
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Former ID |
DIB019445
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Drug Name |
PMID24915291C31
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Synonyms |
GTPL8148; BDBM50020471
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Drug Type |
Small molecular drug
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Indication | Discovery agent [ICD-11: N.A.] | Investigative | [1] | |
Structure |
Download2D MOL
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Formula |
C29H23F3N6O3
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Canonical SMILES |
CC1=C(C=C(C=C1)NC(=O)C2=CC(=CC=C2)C(F)(F)F)C(=O)NC3=CN=C(N=C3)NC4=CC(=CC=C4)NC(=O)C=C
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InChI |
1S/C29H23F3N6O3/c1-3-25(39)35-20-8-5-9-21(13-20)38-28-33-15-23(16-34-28)37-27(41)24-14-22(11-10-17(24)2)36-26(40)18-6-4-7-19(12-18)29(30,31)32/h3-16H,1H2,2H3,(H,35,39)(H,36,40)(H,37,41)(H,33,34,38)
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InChIKey |
BTWVWABAWDKQNJ-UHFFFAOYSA-N
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CAS Number |
CAS 1431727-00-2
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PubChem Compound ID | ||||
PubChem Substance ID |
References | Top | |||
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REF 1 | Discovery of a series of 2,5-diaminopyrimidine covalent irreversible inhibitors of Bruton's tyrosine kinase with in vivo antitumor activity. J Med Chem. 2014 Jun 26;57(12):5112-28. |
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