COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL546849
Chemical Name: (2E,9bR)-6-acetyl-2-(1-{[(1S)-1-(1H-benzimidazol-2-yl)-2-methylpropyl]amino}ethylidene)-7,9-dihydroxy-8,9b-dimethyldibenzo[b,d]furan-1,3(2H,9bH)-dione
Smiles: O=C1C=C2Oc3c([C@]2(C(=O)/C/1=C(/N[C@H](c1nc2c([nH]1)cccc2)C(C)C)\C)C)c(O)c(c(c3C(=O)C)O)C

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Molecular Weight: 515.57
Empirical Formula: C29H29N3O6

Physical State: Dry powder
Available Amount: 305 mg

Lipinsky:
logP: 5.711
Rotatable bonds: 4
H-donors: 4
H-acceptors: 6
PSA: 141
Number of rings: 5

     

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