COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK369526
Chemical Name: N-{(E)-[4-(biphenyl-4-ylethynyl)phenyl]methylidene}-2-chloro-4-nitroaniline
Smiles: Clc1cc(ccc1/N=C/c1ccc(cc1)C#Cc1ccc(cc1)c1ccccc1)[N+](=O)[O-]

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Molecular Weight: 436.9
Empirical Formula: C27H17ClN2O2

Physical State: Dry powder
Available Amount: 87 mg

Lipinsky:
logP: 8.234
Rotatable bonds: 0
H-donors: 0
H-acceptors: 2
PSA: 58
Number of rings: 4

     

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