COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL539543
Chemical Name: N-[(11aS)-11-hydroxy-5-oxo-2,3,5,11a-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzodiazepin-7-yl]-3-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)propanamide
Smiles: O=C(Nc1ccc2c(c1)C(=O)N1CCC[C@H]1C(=N2)O)CCn1nnc2c(c1=O)cccc2

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Molecular Weight: 432.44
Empirical Formula: C22H20N6O4

Physical State: Dry powder
Available Amount: 57 mg

Lipinsky:
logP: -0.946
Rotatable bonds: 4
H-donors: 2
H-acceptors: 4
PSA: 127
Number of rings: 5

     

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