COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL011291
Chemical Name: (2S,3R)-2-(1-((S)-2-((tert-butoxycarbonyl)amino)-3-(1H-indol-3-yl)propanoyl)piperidine-4-carboxamido)-3-methylpentanoicacid
Smiles: CCC([C@@H](C(=O)O)NC(=O)C1CCN(CC1)C(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)OC(C)(C)C)C

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Molecular Weight: 528.65
Empirical Formula: C28H40N4O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.617
Rotatable bonds: 9
H-donors: 4
H-acceptors: 6
PSA: 140
Number of rings: 3

     

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