COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK610096
Chemical Name: 3-{2-[(1,3-benzothiazol-2-ylsulfanyl)methyl]-8,9-dimethyl-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-7-yl}-N,N-dimethylpropan-1-amine
Smiles: CN(CCCn1c2ncn3c(c2c(c1C)C)nc(n3)CSc1nc2c(s1)cccc2)C

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Molecular Weight: 451.62
Empirical Formula: C22H25N7S2

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 4.351
Rotatable bonds: 6
H-donors: 0
H-acceptors: 0
PSA: 117
Number of rings: 5

     

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