COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK673429
Chemical Name: 2-[(6-{[(E)-(4-chlorophenyl)methylidene]amino}-1,3-benzothiazol-2-yl)sulfanyl]-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)acetamide
Smiles: O=C(Nc1c(C)n(n(c1=O)c1ccccc1)C)CSc1nc2c(s1)cc(cc2)/N=C/c1ccc(cc1)Cl

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Molecular Weight: 548.09
Empirical Formula: C27H22ClN5O2S2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.397
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 131
Number of rings: 5

     

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