COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL535842
Chemical Name: 2-hydroxy-3-{3-oxo-3-[4-(2,3,4-trimethoxybenzyl)piperazin-1-yl]propyl}-3,4-dihydro-5H-1,4-benzodiazepin-5-one
Smiles: COc1c(OC)ccc(c1OC)CN1CCN(CC1)C(=O)CCC1NC(=O)c2c(N=C1O)cccc2

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Molecular Weight: 496.56
Empirical Formula: C26H32N4O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: -0.136
Rotatable bonds: 8
H-donors: 2
H-acceptors: 6
PSA: 112
Number of rings: 4

     

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