COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL528129
Chemical Name: (10R,13S,17S)-17-({[(E)-(3,5-dichloro-2-hydroxyphenyl)methylidene]amino}methyl)-10,13-dimethyl-1,2,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydrospiro[cyclopenta[a]phenanthrene-3,2'-[1,3]dioxolan]-17-
Smiles: Clc1cc(/C=N/C[C@]2(O)CCC3[C@]2(C)CCC2C3CC=C3[C@]2(C)CCC2(C3)OCCO2)c(c(c1)Cl)O

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Molecular Weight: 534.52
Empirical Formula: C29H37Cl2NO4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.351
Rotatable bonds: 3
H-donors: 2
H-acceptors: 4
PSA: 71
Number of rings: 6

     

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