COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK590712
Chemical Name: (4Z)-4-[(1,3-benzothiazol-2-ylamino)methylidene]-2-(2,4-dimethylphenyl)isoquinoline-1,3(2H,4H)-dione
Smiles: Cc1ccc(c(c1)C)N1C(=O)/C(=C\Nc2nc3c(s2)cccc3)/c2c(C1=O)cccc2

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Molecular Weight: 425.51
Empirical Formula: C25H19N3O2S

Physical State: Dry powder
Available Amount: 158 mg

Lipinsky:
logP: 5.98
Rotatable bonds: 0
H-donors: 1
H-acceptors: 2
PSA: 90
Number of rings: 5

     

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