COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL048707
Chemical Name: 2-{[3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-N'-[(1E,2E)-3-(2-nitrophenyl)prop-2-en-1-ylidene]acetohydrazide
Smiles: O=C(CSc1nc2ccccc2c(=O)n1c1ccc(cc1)Cl)N/N=C/C=C/c1ccccc1[N+](=O)[O-]

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Molecular Weight: 519.97
Empirical Formula: C25H18ClN5O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.669
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 145
Number of rings: 4

     

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