COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK571870
Chemical Name: 1-hydroxy-9-oxo-9H-xanthen-3-ylN-[(4-methylphenyl)sulfonyl]-D-isoleucinate
Smiles: CC[C@@H]([C@H](C(=O)Oc1cc(O)c2c(c1)oc1c(c2=O)cccc1)NS(=O)(=O)c1ccc(cc1)C)C

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Molecular Weight: 495.55
Empirical Formula: C26H25NO7S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.517
Rotatable bonds: 6
H-donors: 2
H-acceptors: 7
PSA: 127
Number of rings: 4

     

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