COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK759529
Chemical Name: N-[(2Z)-3-(1,3-benzodioxol-5-ylmethyl)-4-(3-nitrophenyl)-1,3-thiazol-2(3H)-ylidene]-3-(trifluoromethyl)aniline
Smiles: [O-][N+](=O)c1cccc(c1)c1cs/c(=N\c2cccc(c2)C(F)(F)F)/n1Cc1ccc2c(c1)OCO2

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Saltdata: HBr
Molecular Weight: 499.47
Empirical Formula: C24H16F3N3O4S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 7.995
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 105
Number of rings: 5

     

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