COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK678225
Chemical Name: 3-(4-tert-butylphenyl)-10-[(2E)-3-phenylprop-2-enoyl]-11-(pyridin-3-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: O=C1CC(CC2=C1C(c1cccnc1)N(C(=O)/C=C/c1ccccc1)c1c(N2)cccc1)c1ccc(cc1)C(C)(C)C

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Molecular Weight: 553.7
Empirical Formula: C37H35N3O2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 6.637
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 62
Number of rings: 6

     

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