COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK579261
Chemical Name: (4E)-2-(3,4-dimethylphenyl)-4-[(1,3-thiazol-2-ylamino)methylidene]isoquinoline-1,3(2H,4H)-dione
Smiles: O=C1/C(=C/Nc2nccs2)/c2ccccc2C(=O)N1c1ccc(c(c1)C)C

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Molecular Weight: 375.45
Empirical Formula: C21H17N3O2S

Physical State: Dry powder
Available Amount: 130 mg

Lipinsky:
logP: 4.329
Rotatable bonds: 0
H-donors: 1
H-acceptors: 2
PSA: 90
Number of rings: 4

     

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