Name: AZ1508
Rating: 5 (10 reviews)

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类似物检索

HIT ID:HIT212667981
Cas No:1817736-04-1
常用名:AZ1508
别名:MC-Lys-MMETA
IUPAC:(2S,4R)-4-({2-[(1R,3R)-1-(acetyloxy)-3-[(2S,3S)-2-{[(2R,4R)-1,4-dimethylpiperidin-2-yl]formamido}-N-ethyl-3-methylpentanamido]-4-methylpentyl]-1,3-thiazol-4-yl}formamido)-5-{4-[(2S)-6-amino-2-[6-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)hexanamido]hexanamido]phenyl}-2-methylpentanoic acid
IUPAC:(2S,4R)-4-({2-[(1R,3R)-1-(acetyloxy)-3-[(2S,3S)-2-{[(2R,4R)-1,4-dimethylpiperidin-2-yl]formamido}-N-ethyl-3-methylpentanamido]-4-methylpentyl]-1,3-thiazol-4-yl}formamido)-5-{4-[(2S)-6-amino-2-[6-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)hexanamido]hexanamido]phenyl}-2-methylpentanoic acid
InChI key:DONIIAXVJUFSOY-FJTITLMZSA-N

分子式:C56H85N9O11S
分子量:1092.41
氢键供体数 (HBD):6
氢键受体数 (HBA):13
LogP:2.651032
SMILES:[H][C@](NC(=O)[C@H]1C[C@H](C)CCN1C)([C@@H](C)CC)C(=O)N(CC)[C@H](C[C@@H](OC(C)=O)c1nc(cs1)C(=O)N[C@H](C[C@H](C)C(O)=O)Cc1ccc(NC(=O)[C@H](CCCCN)NC(=O)CCCCCN2C(=O)C=CC2=O)cc1)C(C)C |c:71|
SMILES:[H][C@](NC(=O)[C@H]1C[C@H](C)CCN1C)([C@@H](C)CC)C(=O)N(CC)[C@H](C[C@@H](OC(C)=O)c1nc(cs1)C(=O)N[C@H](C[C@H](C)C(O)=O)Cc1ccc(NC(=O)[C@H](CCCCN)NC(=O)CCCCCN2C(=O)C=CC2=O)cc1)C(C)C |c:71|

AZ1508, a tubulin inhibitor[1], serves as a drug-linker conjugate for antibody-drug conjugates (ADC) targeting breast and stomach cancer treatment.

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