COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL547286
Chemical Name: N~2~-{(1E)-1-[(9bR)-6-acetyl-7,9-dihydroxy-8,9b-dimethyl-1,3-dioxo-3,9b-dihydrodibenzo[b,d]furan-2(1H)-ylidene]ethyl}-N-methyl-L-alaninamide
Smiles: CNC(=O)[C@@H](N/C(=C/1\C(=O)C=C2[C@@](C1=O)(C)c1c(O)c(C)c(c(c1O2)C(=O)C)O)/C)C

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Molecular Weight: 428.44
Empirical Formula: C22H24N2O7

Physical State: Dry powder
Available Amount: 303 mg

Lipinsky:
logP: 2.349
Rotatable bonds: 5
H-donors: 4
H-acceptors: 7
PSA: 142
Number of rings: 3

     

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