COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL156212
Chemical Name: 4-{[1-(2-chloro-5-fluorophenyl)-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]carbonyl}piperazin-2-one
Smiles: O=C1NCCN(C1)C(=O)c1cnn(c1n1cccc1)c1cc(F)ccc1Cl

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Molecular Weight: 387.8
Empirical Formula: C18H15ClFN5O2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0.443
Rotatable bonds: 1
H-donors: 1
H-acceptors: 2
PSA: 72
Number of rings: 4

     

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