COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK023205
Chemical Name: 2-(1,3-benzothiazol-2-yl)-4-{[(1E,2E)-3-(3-nitrophenyl)prop-2-en-1-ylidene]amino}phenol
Smiles: Oc1ccc(cc1c1nc2c(s1)cccc2)/N=C/C=C/c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 401.45
Empirical Formula: C22H15N3O3S

Physical State: Dry powder
Available Amount: 230 mg

Lipinsky:
logP: 7.084
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 119
Number of rings: 4

     

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