COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL552641
Chemical Name: N-(2-oxoazepan-3-yl)-2-({[(3Z)-20-oxopregn-4-en-3-ylidene]amino}oxy)acetamide
Smiles: O=C(NC1CCCCNC1=O)CO/N=C\1/CCC2(C(=C1)CCC1C2CCC2(C1CCC2C(=O)C)C)C

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Molecular Weight: 497.68
Empirical Formula: C29H43N3O4

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.792
Rotatable bonds: 5
H-donors: 2
H-acceptors: 4
PSA: 96
Number of rings: 5

     

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