COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK143156
Chemical Name: dimethyl5-({(1Z)-1-[1-(1,3-benzothiazol-2-yl)-5-oxo-3-propyl-1,5-dihydro-4H-pyrazol-4-ylidene]ethyl}amino)benzene-1,3-dicarboxylate
Smiles: CCCC1=NN(C(=O)/C/1=C(\Nc1cc(cc(c1)C(=O)OC)C(=O)OC)/C)c1nc2c(s1)cccc2

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Molecular Weight: 492.56
Empirical Formula: C25H24N4O5S

Physical State: Dry powder
Available Amount: 156 mg

Lipinsky:
logP: 5.579
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 138
Number of rings: 4

     

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