COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL526946
Chemical Name: 2-({[(3Z,8xi,9xi,14xi)-17-hydroxy-20-oxopregn-4-en-3-ylidene]amino}oxy)-N-[2-(1H-indol-3-yl)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)NCCc1c[nH]c2c1cccc2

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Molecular Weight: 545.72
Empirical Formula: C33H43N3O4

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.924
Rotatable bonds: 7
H-donors: 3
H-acceptors: 4
PSA: 103
Number of rings: 6

     

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