COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK945653
Chemical Name: 2-[(1,3-benzoxazol-2-ylsulfanyl)methyl]-7-(3,4-dimethylphenyl)-8,9-dimethyl-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: Cc1ccc(cc1C)n1c2ncn3c(c2c(c1C)C)nc(n3)CSc1nc2c(o1)cccc2

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Molecular Weight: 454.56
Empirical Formula: C25H22N6OS

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 6.966
Rotatable bonds: 3
H-donors: 0
H-acceptors: 1
PSA: 99
Number of rings: 6

     

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