COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK262788
Chemical Name: 3,3-dimethyl-11-[4-(methylsulfanyl)phenyl]-10-[2-(morpholin-4-yl)-2-oxoethyl]-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: CSc1ccc(cc1)C1C2=C(Nc3c(N1CC(=O)N1CCOCC1)cccc3)CC(CC2=O)(C)C

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Molecular Weight: 491.65
Empirical Formula: C28H33N3O3S

Physical State: Dry powder
Available Amount: 120 mg

Lipinsky:
logP: 3.865
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 87
Number of rings: 5

     

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