COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK150015
Chemical Name: (4E)-2-(1H-benzimidazol-2-yl)-4-{[(3,5-dimethoxyphenyl)amino]methylidene}-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: COc1cc(N/C=C/2\C(=NN(C2=O)c2nc3c([nH]2)cccc3)C)cc(c1)OC

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Molecular Weight: 377.4
Empirical Formula: C20H19N5O3

Physical State: Dry powder
Available Amount: 201 mg

Lipinsky:
logP: 2.601
Rotatable bonds: 2
H-donors: 2
H-acceptors: 3
PSA: 91
Number of rings: 4

     

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