COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK052656
Chemical Name: 4-[3-(4-tert-butylphenyl)-1-hydroxy-11-(pyridin-3-yl)-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]-4-oxobutanoicacid
Smiles: OC(=O)CCC(=O)N1c2ccccc2N=C2C(=C(O)CC(C2)c2ccc(cc2)C(C)(C)C)C1c1cccnc1

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Molecular Weight: 523.63
Empirical Formula: C32H33N3O4

Physical State: Dry powder
Available Amount: 312 mg

Lipinsky:
logP: 5.341
Rotatable bonds: 6
H-donors: 2
H-acceptors: 4
PSA: 103
Number of rings: 5

     

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