COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL528124
Chemical Name: (8xi,9xi,14xi)-17-({[(E)-(5-bromo-2-hydroxy-3-methoxyphenyl)methylidene]amino}methyl)androstan-17-ol
Smiles: COc1cc(Br)cc(c1O)/C=N/CC1(O)CCC2[C@]1(C)CCC1C2CCC2[C@]1(C)CCCC2

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Molecular Weight: 518.53
Empirical Formula: C28H40BrNO3

Physical State: Dry powder
Available Amount: 307 mg

Lipinsky:
logP: 8.914
Rotatable bonds: 6
H-donors: 2
H-acceptors: 3
PSA: 62
Number of rings: 5

     

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