COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK839898
Chemical Name: 2-[4-(1,3-benzothiazol-2-yl)-1H-pyrazol-3-yl]-5-[(4-nitrobenzyl)oxy]phenol
Smiles: Oc1cc(OCc2ccc(cc2)[N+](=O)[O-])ccc1c1n[nH]cc1c1nc2c(s1)cccc2

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Molecular Weight: 444.47
Empirical Formula: C23H16N4O4S

Physical State: Dry powder
Available Amount: 318 mg

Lipinsky:
logP: 4.669
Rotatable bonds: 5
H-donors: 2
H-acceptors: 4
PSA: 145
Number of rings: 5

     

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