COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK716733
Chemical Name: 3-benzyl-4,8-dimethyl-7-[2-nitro-4-(trifluoromethyl)phenoxy]-2H-chromen-2-one
Smiles: O=c1oc2c(C)c(ccc2c(c1Cc1ccccc1)C)Oc1ccc(cc1[N+](=O)[O-])C(F)(F)F

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Molecular Weight: 469.42
Empirical Formula: C25H18F3NO5

Physical State: Dry powder
Available Amount: 315 mg

Lipinsky:
logP: 6.796
Rotatable bonds: 3
H-donors: 0
H-acceptors: 5
PSA: 81
Number of rings: 4

     

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