COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL528472
Chemical Name: (8xi,9xi,10xi,13xi,14xi)-17-hydroxy-3,20-dioxopregn-4-en-21-yl4-[(2,3-dimethoxybenzyl)amino]-4-oxobutanoate
Smiles: COc1cccc(c1OC)CNC(=O)CCC(=O)OCC(=O)[C@@]1(O)CCC2C1(C)CCC1C2CCC2=CC(=O)CCC12C

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Molecular Weight: 595.73
Empirical Formula: C34H45NO8

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.398
Rotatable bonds: 11
H-donors: 2
H-acceptors: 8
PSA: 128
Number of rings: 5

     

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