COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK059713
Chemical Name: 11-(2-bromo-3,4,5-trimethoxyphenyl)-3,3,7,8-tetramethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: COc1cc(C2Nc3cc(C)c(cc3NC3=C2C(=O)CC(C3)(C)C)C)c(c(c1OC)OC)Br

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Molecular Weight: 515.45
Empirical Formula: C26H31BrN2O4

Physical State: Dry powder
Available Amount: 202 mg

Lipinsky:
logP: 4.722
Rotatable bonds: 4
H-donors: 2
H-acceptors: 4
PSA: 68
Number of rings: 4

     

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