COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL526232
Chemical Name: 2-({[(3Z,8xi,9xi,14xi,17xi)-20-oxopregn-4-en-3-ylidene]amino}oxy)-N-(pyridin-3-ylmethyl)acetamide
Smiles: O=C(NCc1cccnc1)CO/N=C\1/CC[C@]2(C(=C1)CCC1C2CC[C@]2(C1CCC2C(=O)C)C)C

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Molecular Weight: 477.65
Empirical Formula: C29H39N3O3

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.368
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 80
Number of rings: 5

     

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