COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK948244
Chemical Name: methyl2-{[(7-bromo-1-benzoxepin-4-yl)carbonyl]amino}-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=O)C2=Cc3cc(Br)ccc3OC=C2)sc2c1CCC(C2)C

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Molecular Weight: 474.38
Empirical Formula: C22H20BrNO4S

Available Amount: 0 mg

Lipinsky:
logP: 7.839
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 92
Number of rings: 4

     

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