COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL525978
Chemical Name: ({[(3Z,8xi,9xi,14xi)-11,17,21-trihydroxy-20-oxopregn-4-en-3-ylidene]amino}oxy)aceticacid
Smiles: OCC(=O)[C@@]1(O)CCC2[C@]1(C)CC(O)C1C2CCC2=C/C(=N\OCC(=O)O)/CC[C@]12C

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Molecular Weight: 435.52
Empirical Formula: C23H33NO7

Physical State: Dry powder
Available Amount: 260 mg

Lipinsky:
logP: 2.126
Rotatable bonds: 8
H-donors: 4
H-acceptors: 7
PSA: 136
Number of rings: 4

     

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