COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK385152
Chemical Name: N-(4-bromophenyl)-6-tert-butyl-2-{[(E)-(3-nitrophenyl)methylidene]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Smiles: Brc1ccc(cc1)NC(=O)c1c(/N=C/c2cccc(c2)[N+](=O)[O-])sc2c1CCC(C2)C(C)(C)C

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Molecular Weight: 540.48
Empirical Formula: C26H26BrN3O3S

Physical State: Dry powder
Available Amount: 602 mg

Lipinsky:
logP: 8.267
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 115
Number of rings: 4

     

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