COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK860245
Chemical Name: (1E)-1-(3,4-dimethoxyphenyl)-N-(9,10,11,12-tetrahydro-8H-cyclohepta[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-ylmethoxy)ethanimine
Smiles: COc1ccc(cc1OC)/C(=N/OCc1nc2n(n1)cnc1c2c2CCCCCc2s1)/C

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Molecular Weight: 451.55
Empirical Formula: C23H25N5O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.572
Rotatable bonds: 6
H-donors: 0
H-acceptors: 3
PSA: 111
Number of rings: 5

     

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