COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL553169
Chemical Name: (5alpha,8xi,9xi,14xi)-3-oxo-17-{[3-(piperidinium-1-yl)propanoyl]oxy}androstane
Smiles: O=C1CC[C@]2([C@H](C1)CCC1C2CC[C@]2(C1CCC2OC(=O)CC[NH+]1CCCCC1)C)C

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Saltdata: Cl-
Molecular Weight: 430.65
Empirical Formula: C27H44NO3

Physical State: Dry powder
Available Amount: 312 mg

Lipinsky:
logP: 6.063
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 47
Number of rings: 5

     

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