COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL148450
Chemical Name: 1-[1-hydroxy-3,3-dimethyl-11-(pyridin-3-yl)-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]-3-methylbutan-1-one
Smiles: CC(CC(=O)N1C(c2cccnc2)C2=C(O)CC(CC2=Nc2c1cccc2)(C)C)C

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Molecular Weight: 403.52
Empirical Formula: C25H29N3O2

Physical State: Dry powder
Available Amount: 313 mg

Lipinsky:
logP: 4.625
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 65
Number of rings: 4

     

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