COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK956073
Chemical Name: 2-amino-4-{4-[(2-bromophenoxy)methyl]-5-methylthiophen-2-yl}-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
Smiles: N#CC1=C(N)OC2=C(C1c1sc(c(c1)COc1ccccc1Br)C)C(=O)CC(C2)(C)C

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Molecular Weight: 499.43
Empirical Formula: C24H23BrN2O3S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.662
Rotatable bonds: 4
H-donors: 2
H-acceptors: 3
PSA: 113
Number of rings: 4

     

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