COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK968830
Chemical Name: 1-(morpholin-4-yl)-2-({4-[(1E)-3-(morpholin-4-yl)prop-1-en-1-yl]-5-(4-nitrophenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)ethanone
Smiles: O=C(N1CCOCC1)CSc1nnc(n1/C=C/CN1CCOCC1)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 474.54
Empirical Formula: C21H26N6O5S

Available Amount: 0 mg

Lipinsky:
logP: 2.698
Rotatable bonds: 4
H-donors: 0
H-acceptors: 5
PSA: 143
Number of rings: 4

     

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