COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL548022
Chemical Name: (2E)-6-acetyl-2-(1-{[(5-amino-1H-1,2,4-triazol-3-yl)methyl]amino}ethylidene)-7,9-dihydroxy-8,9b-dimethyldibenzo[b,d]furan-1,3(2H,9bH)-dione
Smiles: Nc1[nH]nc(n1)CN/C(=C/1\C(=O)C=C2C(C1=O)(C)c1c(O)c(C)c(c(c1O2)C(=O)C)O)/C

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Molecular Weight: 439.43
Empirical Formula: C21H21N5O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.06
Rotatable bonds: 5
H-donors: 6
H-acceptors: 6
PSA: 180
Number of rings: 4

     

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