COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK382651
Chemical Name: ethyl2-[3-(2,4-dinitrophenoxy)phenyl]-4-oxo-1,3,4,5,6,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidine-7(2H)-carboxylate
Smiles: CCOC(=O)N1CCc2c(C1)sc1c2C(=O)NC(N1)c1cccc(c1)Oc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-]

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Molecular Weight: 539.53
Empirical Formula: C24H21N5O8S

Physical State: Dry powder
Available Amount: 604 mg

Lipinsky:
logP: 2.201
Rotatable bonds: 5
H-donors: 2
H-acceptors: 8
PSA: 199
Number of rings: 5

     

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