COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL533468
Chemical Name: 2-hydroxy-4-{[({[(3E,9xi,14xi,17beta)-17-hydroxy-17-methylandrost-4-en-3-ylidene]amino}oxy)acetyl]amino}-3,3-dimethylbutanoicacid
Smiles: O=C(NCC(C(C(=O)O)O)(C)C)CO/N=C/1\CC[C@]2(C(=C1)CC[C@@H]1C2CC[C@]2(C1CC[C@]2(C)O)C)C

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Molecular Weight: 504.67
Empirical Formula: C28H44N2O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.983
Rotatable bonds: 10
H-donors: 4
H-acceptors: 6
PSA: 128
Number of rings: 4

     

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