COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL001227
Chemical Name: methyl4-[3-(4-methylphenyl)-1-oxo-10-(thiophen-2-ylcarbonyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-11-yl]benzoate
Smiles: COC(=O)c1ccc(cc1)C1C2=C(Nc3c(N1C(=O)c1cccs1)cccc3)CC(CC2=O)c1ccc(cc1)C

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Molecular Weight: 548.66
Empirical Formula: C33H28N2O4S

Available Amount: 0 mg

Lipinsky:
logP: 6.386
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 103
Number of rings: 6

     

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