COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL524552
Chemical Name: (3alpha,8xi,14xi,17beta)-11-[4-(dimethylamino)phenyl]-17-(prop-1-yn-1-yl)estra-4,9-diene-3,17-diol
Smiles: CC#C[C@]1(O)CCC2[C@]1(C)CC(c1ccc(cc1)N(C)C)C1=C3CC[C@H](C=C3CCC21)O

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Molecular Weight: 431.62
Empirical Formula: C29H37NO2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.457
Rotatable bonds: 1
H-donors: 2
H-acceptors: 2
PSA: 43
Number of rings: 5

     

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