COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK003941
Chemical Name: 3-(4-tert-butylphenyl)-11-(2-chlorophenyl)-10-(thiophen-2-ylcarbonyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: O=C1CC(CC2=C1C(N(c1c(N2)cccc1)C(=O)c1cccs1)c1ccccc1Cl)c1ccc(cc1)C(C)(C)C

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Molecular Weight: 567.15
Empirical Formula: C34H31ClN2O2S

Physical State: Dry powder
Available Amount: 102 mg

Lipinsky:
logP: 8.232
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 77
Number of rings: 6

     

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