COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL553359
Chemical Name: (3aR,3a1R,5R,5aR,10bR)-6-acetyl-5-(methoxycarbonyl)-13-methyl-1,2,3,3a1,4,5,6,11,12,13-decahydro-3a,5a-ethanoindolizino[8,1-cd]carbazol-13-iumiodide
Smiles: COC(=O)[C@@H]1C[C@@]23CCC[N+]4([C@H]3[C@@]3([C@]1(CC2)N(C(=O)C)c1c3cccc1)CC4)C

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Saltdata: I-
Molecular Weight: 395.52
Empirical Formula: C24H31N2O3

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: -1.652
Rotatable bonds: 1
H-donors: 0
H-acceptors: 3
PSA: 46
Number of rings: 7

     

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