COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK934127
Chemical Name: 1,1'-(11,12-dihydro-10H-cyclopenta[4,5]thieno[3,2-e]bis[1,2,4]triazolo[4,3-a:4',3'-c]pyrimidine-3,7-diyldisulfanediyl)bis[3-(4-chlorophenyl)propan-2-one]
Smiles: O=C(Cc1ccc(cc1)Cl)CSc1nnc2n1c1sc3c(c1c1n2c(SCC(=O)Cc2ccc(cc2)Cl)nn1)CCC3

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Molecular Weight: 653.64
Empirical Formula: C29H22Cl2N6O2S3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 9.674
Rotatable bonds: 8
H-donors: 0
H-acceptors: 2
PSA: 173
Number of rings: 7

     

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