COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK994301
Chemical Name: 3-[(5Z)-5-(1,3-benzodioxol-5-ylmethylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-N-(4-bromophenyl)propanamide
Smiles: O=C(Nc1ccc(cc1)Br)CCN1C(=S)S/C(=C\c2ccc3c(c2)OCO3)/C1=O

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Molecular Weight: 491.39
Empirical Formula: C20H15BrN2O4S2

Physical State: Dry powder
Available Amount: 53 mg

Lipinsky:
logP: 4.371
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 125
Number of rings: 4

     

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