COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK016025
Chemical Name: 11-(3,4-dichlorophenyl)-3-(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)c1ccc(c(c1)Cl)Cl)c1cccs1

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Molecular Weight: 441.38
Empirical Formula: C23H18Cl2N2OS

Physical State: Dry powder
Available Amount: 256 mg

Lipinsky:
logP: 4.786
Rotatable bonds: 2
H-donors: 2
H-acceptors: 1
PSA: 69
Number of rings: 5

     

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