COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK149762
Chemical Name: 3-(4-tert-butylphenyl)-11-(thiophen-2-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: O=C1CC(CC2=C1C(Nc1c(N2)cccc1)c1cccs1)c1ccc(cc1)C(C)(C)C

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Molecular Weight: 428.6
Empirical Formula: C27H28N2OS

Physical State: Dry powder
Available Amount: 146 mg

Lipinsky:
logP: 5.409
Rotatable bonds: 1
H-donors: 2
H-acceptors: 1
PSA: 69
Number of rings: 5

     

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