COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL177347
Chemical Name: (3E)-3-[4-(3-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/CC(Nc3c(N2)cccc3)c2cccc(c2)O)/C(=O)O1

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Molecular Weight: 362.39
Empirical Formula: C21H18N2O4

Physical State: Dry powder
Available Amount: 61 mg

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

     

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