COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK149398
Chemical Name: 2-({[5-(phenoxymethyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-3-[3-(trifluoromethyl)phenyl]quinazolin-4(3H)-one
Smiles: O=c1n(c2cccc(c2)C(F)(F)F)c(CSc2nnc(n2c2ccccc2)COc2ccccc2)nc2c1cccc2

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Molecular Weight: 585.61
Empirical Formula: C31H22F3N5O2S

Physical State: Dry powder
Available Amount: 143 mg

Lipinsky:
logP: 7.016
Rotatable bonds: 5
H-donors: 0
H-acceptors: 2
PSA: 97
Number of rings: 6

     

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