COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK757983
Chemical Name: 2-amino-4-(4-hydroxy-3-methoxyphenyl)-7,7-dimethyl-3-nitro-4,6,7,8-tetrahydro-5H-chromen-5-one
Smiles: COc1cc(ccc1O)C1C2=C(OC(=C1[N+](=O)[O-])N)CC(CC2=O)(C)C

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Molecular Weight: 360.37
Empirical Formula: C18H20N2O6

Physical State: Dry powder
Available Amount: 69 mg

Lipinsky:
logP: 1.172
Rotatable bonds: 3
H-donors: 3
H-acceptors: 6
PSA: 127
Number of rings: 3

     

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