COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK045517
Chemical Name: 3-[(2E)-2-(1-carbamothioyl-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene)hydrazinyl]benzoicacid
Smiles: NC(=S)N1N=C(/C(=N\Nc2cccc(c2)C(=O)O)/C1=O)C

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Molecular Weight: 305.32
Empirical Formula: C12H11N5O3S

Physical State: Dry powder
Available Amount: 67 mg

Lipinsky:
logP: -0.192
Rotatable bonds: 2
H-donors: 4
H-acceptors: 3
PSA: 152
Number of rings: 2

     

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