COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK589359
Chemical Name: (4E)-2-(2-chloro-4-fluorophenyl)-4-({[3-(methylsulfanyl)phenyl]amino}methylidene)isoquinoline-1,3(2H,4H)-dione
Smiles: CSc1cccc(c1)N/C=C/1\c2ccccc2C(=O)N(C1=O)c1ccc(cc1Cl)F

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Molecular Weight: 438.91
Empirical Formula: C23H16ClFN2O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.555
Rotatable bonds: 1
H-donors: 1
H-acceptors: 2
PSA: 74
Number of rings: 4

     

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