COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL525957
Chemical Name: 4-{[(8xi,9xi,14xi,16xi,17xi)-26-(acetylamino)furosta-5,20(22)-dien-3-yl]oxy}-4-oxobutanoicacid
Smiles: CC(CCC1=C(C)C2C(O1)CC1[C@]2(C)CCC2C1CC=C1[C@]2(C)CCC(C1)OC(=O)CCC(=O)O)CNC(=O)C

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Molecular Weight: 555.76
Empirical Formula: C33H49NO6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.013
Rotatable bonds: 11
H-donors: 2
H-acceptors: 6
PSA: 101
Number of rings: 5

     

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