COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK548959
Chemical Name: 2-(2-{[4-amino-6-(propan-2-yl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}ethyl)-1H-isoindole-1,3(2H)-dione
Smiles: CC(C1OCc2c(C1)c1c(N)nc(nc1s2)SCCN1C(=O)c2c(C1=O)cccc2)C

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Molecular Weight: 454.57
Empirical Formula: C22H22N4O3S2

Physical State: Dry powder
Available Amount: 306 mg

Lipinsky:
logP: 6.053
Rotatable bonds: 4
H-donors: 2
H-acceptors: 3
PSA: 151
Number of rings: 5

     

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