Name: DBPR-110
Rating: 5 (10 reviews)

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HIT ID:HIT214318371
Cas No:1310694-75-7
常用名:DBPR-110
别名:MB-110, MB110, MB 110
IUPAC:N-[(1R)-2-[(2S)-2-[5-(4'-{2-[(2S)-1-[(2R)-2-(cyclopropylformamido)-2-phenylacetyl]pyrrolidin-2-yl]-1,3-thiazol-5-yl}-[1,1'-biphenyl]-4-yl)-1,3-thiazol-2-yl]pyrrolidin-1-yl]-2-oxo-1-phenylethyl]cyclopropanecarboxamide
IUPAC:N-[(1R)-2-[(2S)-2-[5-(4'-{2-[(2S)-1-[(2R)-2-(cyclopropylformamido)-2-phenylacetyl]pyrrolidin-2-yl]-1,3-thiazol-5-yl}-[1,1'-biphenyl]-4-yl)-1,3-thiazol-2-yl]pyrrolidin-1-yl]-2-oxo-1-phenylethyl]cyclopropanecarboxamide
InChI key:FZCLQOXUWMCXCV-XCIZVNRNSA-N

分子式:C50H48N6O4S2
分子量:861.09
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:O=C(N[C@@H](C(=O)N1CCC[C@H]1c1ncc(s1)-c1ccc(cc1)-c1ccc(cc1)-c1cnc(s1)[C@@H]1CCCN1C(=O)[C@H](NC(=O)C1CC1)c1ccccc1)c1ccccc1)C1CC1
SMILES:O=C(N[C@@H](C(=O)N1CCC[C@H]1c1ncc(s1)-c1ccc(cc1)-c1ccc(cc1)-c1cnc(s1)[C@@H]1CCCN1C(=O)[C@H](NC(=O)C1CC1)c1ccccc1)c1ccccc1)C1CC1

DBPR-110 is a nonstructural protein 5A (NS5A) inhibitor. DBPR-110 reduced the reporter expression of the HCV1b replicon with a EC(50) and a selective index value of 3.9 ± 0.9 pM and >12,800,000, respectively. DBPR-110 reduced HCV2a replicon activity with an EC(50) and a selective index value of 228.8 ± 98.4 pM and >173,130, respectively.

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