Name: HTL22562
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT214323031
Cas No:2097085-63-5
常用名:HTL22562
IUPAC:(2R)-3-(7-methyl-1H-indazol-5-yl)-2-[({2'-oxo-1',2'-dihydrospiro[piperidine-4,4'-pyrido[2,3-d][1,3]oxazin]-1-yl}carbonyl)amino]-N-[(2S)-1-oxo-3-(piperidin-4-yl)-1-[4-(pyridin-4-yl)piperazin-1-yl]propan-2-yl]propanamide
IUPAC:(2R)-3-(7-methyl-1H-indazol-5-yl)-2-[({2'-oxo-1',2'-dihydrospiro[piperidine-4,4'-pyrido[2,3-d][1,3]oxazin]-1-yl}carbonyl)amino]-N-[(2S)-1-oxo-3-(piperidin-4-yl)-1-[4-(pyridin-4-yl)piperazin-1-yl]propan-2-yl]propanamide
InChI key:LIPVCPUZWNTQHV-SAIUNTKASA-N

分子式:C40H49N11O5
分子量:763.904
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:Cc1cc(C[C@@H](NC(=O)N2CCC3(CC2)OC(=O)Nc2ncccc32)C(=O)N[C@@H](CC2CCNCC2)C(=O)N2CCN(CC2)c2ccncc2)cc2cn[nH]c12
SMILES:Cc1cc(C[C@@H](NC(=O)N2CCC3(CC2)OC(=O)Nc2ncccc32)C(=O)N[C@@H](CC2CCNCC2)C(=O)N2CCN(CC2)c2ccncc2)cc2cn[nH]c12

HTL22562 is a calcitonin gene-related peptide (CGRP) receptor antagonist for acute treatment of migraine.

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