COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL492063
Chemical Name: methyl3-[5-(1,3-benzothiazol-2-yl)furan-2-yl]-3-(3-hydroxy-6-{[4-(4-methoxyphenyl)piperazin-1-yl]methyl}-4-oxo-4H-pyran-2-yl)propanoate
Smiles: COC(=O)CC(c1oc(CN2CCN(CC2)c2ccc(cc2)OC)cc(=O)c1O)c1ccc(o1)c1nc2c(s1)cccc2

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Molecular Weight: 601.68
Empirical Formula: C32H31N3O7S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.903
Rotatable bonds: 8
H-donors: 1
H-acceptors: 7
PSA: 142
Number of rings: 6

     

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