COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK018149
Chemical Name: 2,2'-[(6,6-dimethyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine-2,4-diyl)disulfanediyl]bis[1-(4-bromophenyl)ethanone]
Smiles: Brc1ccc(cc1)C(=O)CSc1nc(SCC(=O)c2ccc(cc2)Br)c2c(n1)sc1c2CC(OC1)(C)C

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Molecular Weight: 678.49
Empirical Formula: C27H22Br2N2O3S3

Physical State: Dry powder
Available Amount: 477 mg

Lipinsky:
logP: 9.417
Rotatable bonds: 6
H-donors: 0
H-acceptors: 3
PSA: 147
Number of rings: 5

     

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