COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL084044
Chemical Name: 1-(6-{[2-(1,3-benzothiazol-2-ylamino)-2-oxoethyl]sulfanyl}pyrimidin-4-yl)-N-cyclopropyl-1H-pyrazole-3-carboxamide
Smiles: O=C(Nc1nc2c(s1)cccc2)CSc1ncnc(c1)n1ccc(n1)C(=O)NC1CC1

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Molecular Weight: 451.53
Empirical Formula: C20H17N7O2S2

Physical State: Dry powder
Available Amount: 53 mg

Lipinsky:
logP: 2.044
Rotatable bonds: 5
H-donors: 2
H-acceptors: 2
PSA: 168
Number of rings: 5

     

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