COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL551627
Chemical Name: (4aR)-8-[(2E)-3-(dimethylamino)prop-2-enoyl]-5,7-dihydroxy-3,4a,6-trimethyl-1-phenyl-1,4a-dihydro-4H-[1]benzofuro[3,2-f]indazol-4-one
Smiles: CN(/C=C/C(=O)c1c(O)c(C)c(c2c1OC1=Cc3c(C(=O)[C@]21C)c(nn3c1ccccc1)C)O)C

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Molecular Weight: 471.51
Empirical Formula: C27H25N3O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.428
Rotatable bonds: 4
H-donors: 2
H-acceptors: 5
PSA: 104
Number of rings: 5

     

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