COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL533225
Chemical Name: (5aS,6R,12S)-3,6,9-trimethyldecahydro-3,12-epoxy[1,2]dioxepino[4,3-i]isochromen-10-yl4-[(1-hydroxy-2-methylpropan-2-yl)amino]-4-oxobutanoate
Smiles: OCC(NC(=O)CCC(=O)OC1O[C@H]2OC3(C)CC[C@@H]4C2(C(C1C)CC[C@H]4C)OO3)(C)C

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Molecular Weight: 455.55
Empirical Formula: C23H37NO8

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.491
Rotatable bonds: 8
H-donors: 2
H-acceptors: 8
PSA: 112
Number of rings: 4

     

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