COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL176802
Chemical Name: (3E)-3-[4-(2-hydroxyphenyl)-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-ylidene]-6-methyl-2H-pyran-2,4(3H)-dione
Smiles: CC1=CC(=O)/C(=C/2\Nc3ccccc3NC(C2)c2ccccc2O)/C(=O)O1

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Molecular Weight: 362.39
Empirical Formula: C21H18N2O4

Physical State: Dry powder
Available Amount: 59 mg

Lipinsky:
logP: 2.183
Rotatable bonds: 2
H-donors: 3
H-acceptors: 4
PSA: 87
Number of rings: 4

     

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