COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK231882
Chemical Name: (4E)-2-(1,3-benzothiazol-2-yl)-4-{1-[(3-methoxypropyl)amino]ethylidene}-5-propyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: COCCCN/C(=C/1\C(=NN(C1=O)c1nc2c(s1)cccc2)CCC)/C

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Molecular Weight: 372.49
Empirical Formula: C19H24N4O2S

Physical State: Dry powder
Available Amount: 112 mg

Lipinsky:
logP: 3.529
Rotatable bonds: 6
H-donors: 1
H-acceptors: 2
PSA: 95
Number of rings: 3

     

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