COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL531217
Chemical Name: trans-4-{[(N-{[(3S)-2-(tert-butoxycarbonyl)-1,2,3,4-tetrahydroisoquinolin-3-yl]carbonyl}-L-methionyl)amino]methyl}cyclohexanecarboxylicacid
Smiles: CSCC[C@@H](C(=O)NC[C@@H]1CC[C@H](CC1)C(=O)O)NC(=O)[C@@H]1Cc2ccccc2CN1C(=O)OC(C)(C)C

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Molecular Weight: 547.72
Empirical Formula: C28H41N3O6S

Physical State: Dry powder
Available Amount: 57 mg

Lipinsky:
logP: 3.121
Rotatable bonds: 7
H-donors: 3
H-acceptors: 6
PSA: 150
Number of rings: 3

     

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