COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK100299
Chemical Name: (6E)-2-ethyl-5-imino-6-{[5-(2-methoxy-4-nitrophenyl)furan-2-yl]methylidene}-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: COc1cc(ccc1c1ccc(o1)/C=C\1/C(=O)N=c2n(C1=N)nc(s2)CC)[N+](=O)[O-]

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Molecular Weight: 425.42
Empirical Formula: C19H15N5O5S

Physical State: Dry powder
Available Amount: 187 mg

Lipinsky:
logP: 2.371
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 162
Number of rings: 4

     

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