COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL159571
Chemical Name: 1-(4-bromophenyl)-N-[(2E)-5-(methoxymethyl)-1,3,4-thiadiazol-2(3H)-ylidene]-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide
Smiles: COCc1n[nH]/c(=N\C(=O)c2cnn(c2n2cccc2)c2ccc(cc2)Br)/s1

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Molecular Weight: 459.33
Empirical Formula: C18H15BrN6O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.888
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 111
Number of rings: 4

     

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