COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL251590
Chemical Name: 4-[(2Z)-1,3-benzothiazol-2(3H)-ylideneamino]-2-[(4-methylpiperazin-1-yl)methyl]-4-oxobutanoicacid
Smiles: CN1CCN(CC1)CC(C(=O)O)CC(=O)/N=c/1\sc2c([nH]1)cccc2

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Molecular Weight: 362.45
Empirical Formula: C17H22N4O3S

Physical State: Dry powder
Available Amount: 311 mg

Lipinsky:
logP: 1.617
Rotatable bonds: 5
H-donors: 2
H-acceptors: 3
PSA: 110
Number of rings: 3

     

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