COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL548938
Chemical Name: (2E)-6-acetyl-7,9-dihydroxy-8,9b-dimethyl-2-[1-({2-phenyl-1-[5-(propan-2-yl)-1H-1,2,4-triazol-3-yl]ethyl}amino)ethylidene]dibenzo[b,d]furan-1,3(2H,9bH)-dione
Smiles: C/C(=C\1/C(=O)C=C2C(C1=O)(C)c1c(O)c(C)c(c(c1O2)C(=O)C)O)/NC(c1n[nH]c(n1)C(C)C)Cc1ccccc1

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Molecular Weight: 556.62
Empirical Formula: C31H32N4O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.731
Rotatable bonds: 7
H-donors: 4
H-acceptors: 6
PSA: 154
Number of rings: 5

     

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