COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL084014
Chemical Name: 1-{6-[(2-{[2-(4-chlorophenyl)ethyl]amino}-2-oxoethyl)sulfanyl]pyrimidin-4-yl}-N-cyclopropyl-1H-pyrazole-3-carboxamide
Smiles: O=C(CSc1ncnc(c1)n1ccc(n1)C(=O)NC1CC1)NCCc1ccc(cc1)Cl

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Molecular Weight: 456.96
Empirical Formula: C21H21ClN6O2S

Physical State: Dry powder
Available Amount: 57 mg

Lipinsky:
logP: 1.919
Rotatable bonds: 7
H-donors: 2
H-acceptors: 2
PSA: 127
Number of rings: 4

     

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