COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL035107
Chemical Name: 1-(4-bromophenyl)-2-{[10-(2-methylpropyl)-8,9-dihydro-7H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]sulfanyl}ethanone
Smiles: CC(Cc1nc2sc3c(c2c2c1CCC2)ncn1c3nnc1SCC(=O)c1ccc(cc1)Br)C

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Molecular Weight: 552.52
Empirical Formula: C25H22BrN5OS2

Physical State: Dry powder
Available Amount: 312 mg

Lipinsky:
logP: 6.875
Rotatable bonds: 5
H-donors: 0
H-acceptors: 1
PSA: 126
Number of rings: 6

     

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