COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL020340
Chemical Name: 2-[2-(4-chlorophenyl)-3-(4-nitrophenyl)-4,6-dioxohexahydro-5H-pyrrolo[3,4-d][1,2]oxazol-5-yl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Smiles: N#Cc1c(sc2c1CCCC2)N1C(=O)C2C(C1=O)ON(C2c1ccc(cc1)[N+](=O)[O-])c1ccc(cc1)Cl

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Molecular Weight: 534.98
Empirical Formula: C26H19ClN4O5S

Physical State: Dry powder
Available Amount: 110 mg

Lipinsky:
logP: 4.036
Rotatable bonds: 0
H-donors: 0
H-acceptors: 5
PSA: 147
Number of rings: 6

     

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