COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL526448
Chemical Name: methyl(1S,4aR,5S)-5-(2-{2-[(cyclohexylamino)methyl]furan-3-yl}ethyl)-1,4a-dimethyl-6-methylidenedecahydronaphthalene-1-carboxylate
Smiles: COC(=O)[C@@]1(C)CCC[C@]2(C1CCC(=C)[C@@H]2CCc1ccoc1CNC1CCCCC1)C

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Saltdata: HCl
Molecular Weight: 441.65
Empirical Formula: C28H43NO3

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 7.932
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 51
Number of rings: 4

     

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