COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL369146
Chemical Name: (2E,5Z)-5-(1,3-benzodioxol-5-ylmethylidene)-2-[(4-bromophenyl)imino]-3-methyl-1,3-thiazolidin-4-one
Smiles: Brc1ccc(cc1)/N=C\1/S/C(=C\c2ccc3c(c2)OCO3)/C(=O)N1C

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Molecular Weight: 417.28
Empirical Formula: C18H13BrN2O3S

Physical State: Dry powder
Available Amount: 1072 mg

Lipinsky:
logP: 5.581
Rotatable bonds: 1
H-donors: 0
H-acceptors: 3
PSA: 76
Number of rings: 4

     

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