COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL550221
Chemical Name: N~2~-[3-({(1E)-1-[(9bR)-6-acetyl-7,9-dihydroxy-8,9b-dimethyl-1,3-dioxo-3,9b-dihydrodibenzo[b,d]furan-2(1H)-ylidene]ethyl}amino)phenyl]-N~2~-(methylsulfonyl)glycinamide
Smiles: NC(=O)CN(S(=O)(=O)C)c1cccc(c1)N/C(=C/1\C(=O)C=C2[C@@](C1=O)(C)c1c(O)c(C)c(c(c1O2)C(=O)C)O)/C

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Molecular Weight: 569.59
Empirical Formula: C27H27N3O9S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.966
Rotatable bonds: 5
H-donors: 5
H-acceptors: 9
PSA: 201
Number of rings: 4

     

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