COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK792972
Chemical Name: (2Z,5Z)-2-[(4-bromophenyl)imino]-3-ethyl-5-[(2Z)-2-(1-ethyl-3,3-dimethyl-5-phenyl-1,3-dihydro-2H-indol-2-ylidene)ethylidene]-1,3-thiazolidin-4-one
Smiles: CCN1/C(=N/c2ccc(cc2)Br)/S/C(=C\C=C\2/N(CC)c3c(C2(C)C)cc(cc3)c2ccccc2)/C1=O

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Molecular Weight: 572.57
Empirical Formula: C31H30BrN3OS

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 8.524
Rotatable bonds: 3
H-donors: 0
H-acceptors: 1
PSA: 61
Number of rings: 5

     

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