COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK207123
Chemical Name: methyl[(4Z)-4-{1-[(1,3-benzodioxol-5-ylmethyl)amino]ethylidene}-1-(1,3-benzothiazol-2-yl)-5-oxo-4,5-dihydro-1H-pyrazol-3-yl]acetate
Smiles: COC(=O)CC1=NN(C(=O)/C/1=C(\NCc1ccc2c(c1)OCO2)/C)c1nc2c(s1)cccc2

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Molecular Weight: 464.5
Empirical Formula: C23H20N4O5S

Physical State: Dry powder
Available Amount: 83 mg

Lipinsky:
logP: 4.553
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 130
Number of rings: 5

     

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