COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK032935
Chemical Name: 1-[5-(4-chlorophenyl)-1,3,4-thiadiazol-2-yl]-3-(4-nitrophenyl)-1-prop-2-en-1-ylurea
Smiles: C=CCN(c1nnc(s1)c1ccc(cc1)Cl)C(=O)Nc1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 415.86
Empirical Formula: C18H14ClN5O3S

Physical State: Dry powder
Available Amount: 438 mg

Lipinsky:
logP: 5.566
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 132
Number of rings: 3

     

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