COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL552241
Chemical Name: (4aR)-8-acetyl-5,7-dihydroxy-1-(6-methoxy-1,3-benzothiazol-2-yl)-3,4a,6-trimethyl-1,4a-dihydro-4H-[1]benzofuro[3,2-f]indazol-4-one
Smiles: COc1ccc2c(c1)sc(n2)n1nc(c2c1C=C1Oc3c([C@]1(C2=O)C)c(O)c(c(c3C(=O)C)O)C)C

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Molecular Weight: 503.54
Empirical Formula: C26H21N3O6S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 6.406
Rotatable bonds: 4
H-donors: 2
H-acceptors: 6
PSA: 152
Number of rings: 6

     

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