COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL537718
Chemical Name: 2-({[(3E,8xi,9xi,14xi,17beta)-17-hydroxy-17-methylandrosta-1,4-dien-3-ylidene]amino}oxy)-N-[2-(1H-indol-3-yl)ethyl]acetamide
Smiles: O=C(CO/N=C/1\C=C[C@]2(C(=C1)CCC1C2CC[C@]2(C1CC[C@]2(C)O)C)C)NCCc1c[nH]c2c1cccc2

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Molecular Weight: 515.7
Empirical Formula: C32H41N3O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.151
Rotatable bonds: 7
H-donors: 3
H-acceptors: 3
PSA: 86
Number of rings: 6

     

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