COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK175119
Chemical Name: (5E)-1-(4-chlorophenyl)-5-{[1-(4-nitrophenyl)-1H-pyrrol-2-yl]methylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: Clc1ccc(cc1)N1C(=O)NC(=O)/C(=C\c2cccn2c2ccc(cc2)[N+](=O)[O-])/C1=O

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Molecular Weight: 436.81
Empirical Formula: C21H13ClN4O5

Physical State: Dry powder
Available Amount: 150 mg

Lipinsky:
logP: 3.84
Rotatable bonds: 1
H-donors: 1
H-acceptors: 5
PSA: 117
Number of rings: 4

     

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