COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL529271
Chemical Name: (1aR,1bR,4R,4aS,7R,7aS,9aR)-4-((4-(2-fluorophenyl)piperazin-1-yl)methyl)-7,9a-dimethyloctahydro-1aH-oxireno[2',3':7,8]naphtho[8a,1-b]furan-3(4H)-oneoxalate
Smiles: O=C1O[C@@]23[C@H](C1CN1CCN(CC1)c1ccccc1F)CC[C@H]([C@@H]2CC[C@@]1([C@H]3O1)C)C

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Saltdata: (COOH)2
Molecular Weight: 428.55
Empirical Formula: C25H33FN2O3

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.112
Rotatable bonds: 1
H-donors: 0
H-acceptors: 3
PSA: 45
Number of rings: 6

     

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