COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL526371
Chemical Name: N-[2-(3,4-dihydroxyphenyl)ethyl]-2-({[(3Z,8xi,9xi,14xi,17xi)-20-oxopregn-4-en-3-ylidene]amino}oxy)acetamide
Smiles: O=C(CO/N=C\1/CC[C@]2(C(=C1)CCC1C2CC[C@]2(C1CCC2C(=O)C)C)C)NCCc1ccc(c(c1)O)O

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Molecular Weight: 522.68
Empirical Formula: C31H42N2O5

Available Amount: 0 mg

Lipinsky:
logP: 4.807
Rotatable bonds: 9
H-donors: 3
H-acceptors: 5
PSA: 108
Number of rings: 5

     

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