COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL175740
Chemical Name: ethyl2-amino-4-(5-{[(4-chlorophenyl)sulfanyl]methyl}-2,4-dimethylphenyl)-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carboxylate
Smiles: CCOC(=O)C1=C(N)OC2=C(C1c1cc(CSc3ccc(cc3)Cl)c(cc1C)C)C(=O)CC(C2)(C)C

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Molecular Weight: 526.1
Empirical Formula: C29H32ClNO4S

Physical State: Dry powder
Available Amount: 21 mg

Lipinsky:
logP: 6.29
Rotatable bonds: 6
H-donors: 2
H-acceptors: 4
PSA: 103
Number of rings: 4

     

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