COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL003991
Chemical Name: (1aR,2S,5aR,6aR,9S,9aR,9bS)-9-((4-(3,4-dichlorophenyl)piperazin-1-yl)methyl)-2,5a-dimethyloctahydro-2H-oxireno[2',3':4,4a]naphtho[2,3-b]furan-8(9bH)-one
Smiles: O=C1O[C@H]2[C@@H](C1CN1CCN(CC1)c1ccc(c(c1)Cl)Cl)[C@@H]1O[C@@]31[C@](C2)(C)CCC[C@@H]3C

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Molecular Weight: 479.45
Empirical Formula: C25H32Cl2N2O3

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.772
Rotatable bonds: 1
H-donors: 0
H-acceptors: 3
PSA: 45
Number of rings: 6

     

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