COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK149849
Chemical Name: methyl[(4E)-1-(1,3-benzothiazol-2-yl)-4-{1-[(4-methoxyphenyl)amino]ethylidene}-5-oxo-4,5-dihydro-1H-pyrazol-3-yl]acetate
Smiles: COC(=O)CC1=NN(C(=O)/C/1=C(/Nc1ccc(cc1)OC)\C)c1nc2c(s1)cccc2

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Molecular Weight: 436.49
Empirical Formula: C22H20N4O4S

Physical State: Dry powder
Available Amount: 386 mg

Lipinsky:
logP: 4.103
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 121
Number of rings: 4

     

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