COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK270616
Chemical Name: 2-[(1,3-benzothiazol-2-ylsulfanyl)methyl]-12-(4-methoxyphenyl)-9,9-dimethyl-8,9,10,12-tetrahydro-11H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-11-one
Smiles: COc1ccc(cc1)C1C2=C(Oc3c1c1nc(nn1cn3)CSc1nc3c(s1)cccc3)CC(CC2=O)(C)C

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Molecular Weight: 555.68
Empirical Formula: C29H25N5O3S2

Physical State: Dry powder
Available Amount: 407 mg

Lipinsky:
logP: 5.116
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 145
Number of rings: 7

     

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