COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK544712
Chemical Name: 2-{[(2Z)-3-chlorobut-2-en-1-yl]sulfanyl}-6,6-dimethyl-3-(3-methylphenyl)-3,5,6,8-tetrahydro-4H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: C/C(=C/CSc1nc2sc3c(c2c(=O)n1c1cccc(c1)C)CC(SC3)(C)C)/Cl

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Molecular Weight: 463.09
Empirical Formula: C22H23ClN2OS3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.398
Rotatable bonds: 3
H-donors: 0
H-acceptors: 1
PSA: 111
Number of rings: 4

     

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