COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK741117
Chemical Name: 3-{[2-(4-benzylphenyl)-2-oxoethyl]sulfanyl}-1,7,7-trimethyl-1,6,7,9-tetrahydro-5H-pyrano[4',3':4,5]thieno[2,3-d][1,2,4]triazolo[4,3-a]pyrimidin-5-one
Smiles: O=C(c1ccc(cc1)Cc1ccccc1)CSc1nn(c2n1c(=O)c1c(n2)sc2c1CC(C)(C)OC2)C

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Molecular Weight: 530.67
Empirical Formula: C28H26N4O3S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.648
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 128
Number of rings: 6

     

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