COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL548710
Chemical Name: (2E,9bR)-6-acetyl-7,9-dihydroxy-8,9b-dimethyl-2-(1-{[(1S)-1-(1-methyl-1H-benzimidazol-2-yl)ethyl]amino}ethylidene)dibenzo[b,d]furan-1,3(2H,9bH)-dione
Smiles: O=C1C=C2Oc3c([C@]2(C(=O)/C/1=C(/N[C@H](c1nc2c(n1C)cccc2)C)\C)C)c(O)c(c(c3C(=O)C)O)C

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Molecular Weight: 501.54
Empirical Formula: C28H27N3O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.387
Rotatable bonds: 5
H-donors: 3
H-acceptors: 6
PSA: 130
Number of rings: 5

     

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