COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL530171
Chemical Name: (3R)-N-[(2S)-1-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-4-methyl-1-oxopentan-2-yl]-2,2-dimethyl-5-oxo-2,3,5,9b-tetrahydro[1,3]thiazolo[2,3-a]isoindole-3-carboxamide
Smiles: COc1cc(CCNC(=O)[C@@H](NC(=O)[C@H]2N3C(SC2(C)C)c2c(C3=O)cccc2)CC(C)C)ccc1OC

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Molecular Weight: 539.7
Empirical Formula: C29H37N3O5S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.162
Rotatable bonds: 9
H-donors: 2
H-acceptors: 5
PSA: 122
Number of rings: 4

     

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