COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL559617
Chemical Name: N-1,3-benzothiazol-2-yl-N~3~-{[1-benzyl-4-(3-hydroxy-6-methyl-4-oxo-4H-pyran-2-yl)piperidin-4-yl]acetyl}-beta-alaninamide
Smiles: O=C(Nc1nc2c(s1)cccc2)CCNC(=O)CC1(CCN(CC1)Cc1ccccc1)c1oc(C)cc(=O)c1O

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Molecular Weight: 560.67
Empirical Formula: C30H32N4O5S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.732
Rotatable bonds: 7
H-donors: 3
H-acceptors: 5
PSA: 149
Number of rings: 5

     

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