COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL525926
Chemical Name: 2-({[(3Z,8xi,9xi,14xi)-17-hydroxy-20-oxopregn-4-en-3-ylidene]amino}oxy)-N-[2-(4-hydroxyphenyl)ethyl]acetamide
Smiles: O=C(CO/N=C\1/CC[C@]2(C(=C1)CCC1C2CC[C@]2(C1CC[C@]2(O)C(=O)C)C)C)NCCc1ccc(cc1)O

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Molecular Weight: 522.68
Empirical Formula: C31H42N2O5

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.264
Rotatable bonds: 7
H-donors: 3
H-acceptors: 5
PSA: 108
Number of rings: 5

     

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