COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK550308
Chemical Name: 2-(2-{[2-(4-butoxyphenyl)-6,6-dimethyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl]sulfanyl}ethyl)-1H-isoindole-1,3(2H)-dione
Smiles: CCCCOc1ccc(cc1)c1nc(SCCN2C(=O)c3c(C2=O)cccc3)c2c(n1)sc1c2CC(OC1)(C)C

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Molecular Weight: 573.74
Empirical Formula: C31H31N3O4S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 8.722
Rotatable bonds: 6
H-donors: 0
H-acceptors: 4
PSA: 135
Number of rings: 6

     

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