ATR-IN-15 | CAS 2756665-52-6 | AnyMole

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HIT214433429

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HIT214433429

HIT ID:HIT214433429
Cas No:2756665-52-6
常用名:ATR-IN-15
IUPAC:(3R)-3-methyl-4-[6-methyl-2-(1-methyl-1H-pyrazol-5-yl)-8-(1H-pyrazol-3-yl)imidazo[1,5-a]pyrimidin-4-yl]morpholine
IUPAC:(3R)-3-methyl-4-[6-methyl-2-(1-methyl-1H-pyrazol-5-yl)-8-(1H-pyrazol-3-yl)imidazo[1,5-a]pyrimidin-4-yl]morpholine
InChI key:ZZBXMUWXLWRZGV-GFCCVEGCSA-N

分子式:C19H22N8O
分子量:378.44
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:C[C@@H]1COCCN1c1cc(nc2c(nc(C)n12)-c1cc[nH]n1)-c1ccnn1C
SMILES:C[C@@H]1COCCN1c1cc(nc2c(nc(C)n12)-c1cc[nH]n1)-c1ccnn1C

ATR-IN-15 (compound 1) is a highly potent and orally active inhibitor of ATR kinase with an IC50 of 8 nM. Additionally, ATR-IN-15 demonstrates inhibitory activity against several targets, including human colon tumor cells LoVo, DNA-PK, and PI3K, with IC50 values of 47, 663, and 5131 nM, respectively [1].

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6-8周
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