COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL526987
Chemical Name: ({[(3E,8xi,9xi,14xi,17beta)-17-hydroxy-17-methylandrosta-1,4-dien-3-ylidene]amino}oxy)aceticacid
Smiles: OC(=O)CO/N=C/1\C=C[C@]2(C(=C1)CCC1C2CC[C@]2(C1CC[C@]2(C)O)C)C

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Molecular Weight: 373.49
Empirical Formula: C22H31NO4

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.819
Rotatable bonds: 5
H-donors: 2
H-acceptors: 4
PSA: 79
Number of rings: 4

     

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