COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK259075
Chemical Name: (2E)-N-{[2-chloro-5-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl}-3-[5-(2-nitrophenyl)furan-2-yl]prop-2-enamide
Smiles: S=C(Nc1cc(ccc1Cl)c1nc2c(o1)c(C)cc(c2)C)NC(=O)/C=C/c1ccc(o1)c1ccccc1[N+](=O)[O-]

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Molecular Weight: 573.03
Empirical Formula: C29H21ClN4O5S

Physical State: Dry powder
Available Amount: 456 mg

Lipinsky:
logP: 8.492
Rotatable bonds: 4
H-donors: 2
H-acceptors: 5
PSA: 158
Number of rings: 5

     

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