COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK393940
Chemical Name: (2E,5E)-5-{[1-(1,3-benzodioxol-5-yl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2-[(4-methoxyphenyl)imino]-1,3-thiazolidin-4-one
Smiles: COc1ccc(cc1)/N=C/1\NC(=O)/C(=C\c2cc(n(c2C)c2ccc3c(c2)OCO3)C)/S1

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Molecular Weight: 447.51
Empirical Formula: C24H21N3O4S

Physical State: Dry powder
Available Amount: 375 mg

Lipinsky:
logP: 3.864
Rotatable bonds: 1
H-donors: 1
H-acceptors: 4
PSA: 99
Number of rings: 5

     

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