COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK590589
Chemical Name: tert-butyl(3S)-3-({(2S)-1-[(4-methoxyphenyl)amino]-1-oxopropan-2-yl}carbamoyl)-3,4-dihydroisoquinoline-2(1H)-carboxylate
Smiles: COc1ccc(cc1)NC(=O)[C@@H](NC(=O)[C@@H]1Cc2ccccc2CN1C(=O)OC(C)(C)C)C

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Molecular Weight: 453.54
Empirical Formula: C25H31N3O5

Physical State: Dry powder
Available Amount: 317 mg

Lipinsky:
logP: 3.025
Rotatable bonds: 3
H-donors: 2
H-acceptors: 5
PSA: 96
Number of rings: 3

     

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