COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL297516
Chemical Name: 4-[(1E)-3-oxo-2-[(phenylcarbonyl)amino]-3-(prop-2-en-1-ylamino)prop-1-en-1-yl]phenyl4-methylbenzenesulfonate
Smiles: C=CCNC(=O)/C(=C\c1ccc(cc1)OS(=O)(=O)c1ccc(cc1)C)/NC(=O)c1ccccc1

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Molecular Weight: 476.55
Empirical Formula: C26H24N2O5S

Physical State: Dry powder
Available Amount: 138 mg

Lipinsky:
logP: 3.911
Rotatable bonds: 4
H-donors: 2
H-acceptors: 5
PSA: 109
Number of rings: 3

     

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