COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL374671
Chemical Name: methyl4-{[(2E,5Z)-5-({1-[4-(dimethylamino)phenyl]-2,5-dimethyl-1H-pyrrol-3-yl}methylidene)-3-methyl-4-oxo-1,3-thiazolidin-2-ylidene]amino}benzoate
Smiles: COC(=O)c1ccc(cc1)/N=C\1/S/C(=C\c2cc(n(c2C)c2ccc(cc2)N(C)C)C)/C(=O)N1C

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Molecular Weight: 488.61
Empirical Formula: C27H28N4O3S

Physical State: Dry powder
Available Amount: 930 mg

Lipinsky:
logP: 6.683
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 92
Number of rings: 4

     

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