COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL149894
Chemical Name: [11-(3-bromophenyl)-1-hydroxy-3,3-dimethyl-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl](3,4,5-trimethoxyphenyl)methanone
Smiles: COc1c(OC)cc(cc1OC)C(=O)N1c2ccccc2N=C2C(=C(O)CC(C2)(C)C)C1c1cccc(c1)Br

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Molecular Weight: 591.5
Empirical Formula: C31H31BrN2O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.539
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 80
Number of rings: 5

     

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