COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL173082
Chemical Name: 2-amino-7,7-dimethyl-4-{4-[(4-methylbenzyl)oxy]-3-nitrophenyl}-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
Smiles: N#CC1=C(N)OC2=C(C1c1ccc(c(c1)[N+](=O)[O-])OCc1ccc(cc1)C)C(=O)CC(C2)(C)C

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Molecular Weight: 459.5
Empirical Formula: C26H25N3O5

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 4.008
Rotatable bonds: 3
H-donors: 2
H-acceptors: 5
PSA: 131
Number of rings: 4

     

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