COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK168616
Chemical Name: methyl(4Z)-4-{[1-(4-bromophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1-[4-(ethoxycarbonyl)phenyl]-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Smiles: CCOC(=O)c1ccc(cc1)N1C(=O)/C(=C\c2cc(n(c2C)c2ccc(cc2)Br)C)/C(=C1C)C(=O)OC

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Molecular Weight: 563.45
Empirical Formula: C29H27BrN2O5

Physical State: Dry powder
Available Amount: 117 mg

Lipinsky:
logP: 6.578
Rotatable bonds: 5
H-donors: 0
H-acceptors: 5
PSA: 77
Number of rings: 4

     

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