COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL541879
Chemical Name: (1aR,1bR,4R,4aS,7R,7aS,9aR)-4-((4-(5-chloro-2-methylphenyl)piperazin-1-yl)methyl)-7,9a-dimethyloctahydro-1aH-oxireno[2',3':7,8]naphtho[8a,1-b]furan-3(4H)-one
Smiles: O=C1O[C@@]23[C@H](C1CN1CCN(CC1)c1cc(Cl)ccc1C)CC[C@H]([C@@H]2CC[C@@]1([C@H]3O1)C)C

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Molecular Weight: 459.03
Empirical Formula: C26H35ClN2O3

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.166
Rotatable bonds: 1
H-donors: 0
H-acceptors: 3
PSA: 45
Number of rings: 6

     

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