BAY-405
HIT218929558
sdf文件结构编辑类似物检索
HIT ID: HIT218929558
Cas No: 2442532-66-1
分子式: C25H23F5N4O3
分子量: 522.476
常用名: BAY-405
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: N-[3,5-difluoro-4-({3-[1-(trifluoromethyl)cyclopropyl]-1H-pyrrolo[2,3-b]pyridin-4-yl}oxy)phenyl]-2,9-dioxa-4-azaspiro[5.5]undec-3-en-3-amine
IUPAC: N-[3,5-difluoro-4-({3-[1-(trifluoromethyl)cyclopropyl]-1H-pyrrolo[2,3-b]pyridin-4-yl}oxy)phenyl]-2,9-dioxa-4-azaspiro[5.5]undec-3-en-3-amine
SMILES: Fc1cc(NC2=NCC3(CCOCC3)CO2)cc(F)c1Oc1ccnc2[nH]cc(c12)C1(CC1)C(F)(F)F
SMILES: Fc1cc(NC2=NCC3(CCOCC3)CO2)cc(F)c1Oc1ccnc2[nH]cc(c12)C1(CC1)C(F)(F)F
InChI key: FXMIIWBGTCDJJQ-UHFFFAOYSA-N
共显示1个结果
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