COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK590105
Chemical Name: trans-4-{[(N-{[(3S)-2-(tert-butoxycarbonyl)-1,2,3,4-tetrahydroisoquinolin-3-yl]carbonyl}-L-leucyl)amino]methyl}cyclohexanecarboxylicacid
Smiles: CC(C[C@@H](C(=O)NC[C@@H]1CC[C@H](CC1)C(=O)O)NC(=O)[C@@H]1Cc2ccccc2CN1C(=O)OC(C)(C)C)C

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Molecular Weight: 529.68
Empirical Formula: C29H43N3O6

Physical State: Dry powder
Available Amount: 270 mg

Lipinsky:
logP: 3.904
Rotatable bonds: 6
H-donors: 3
H-acceptors: 6
PSA: 125
Number of rings: 3

     

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