COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL526614
Chemical Name: (8xi,9xi,14xi)-20-oxopregna-3,16-dien-3-yl3-(pyrrolidin-1-yl)propanoate
Smiles: O=C(OC1=CC2[C@@](CC1)(C)C1CC[C@]3(C(C1CC2)CC=C3C(=O)C)C)CCN1CCCC1

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Saltdata: HCl
Molecular Weight: 439.64
Empirical Formula: C28H41NO3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.56
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 46
Number of rings: 5

     

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