COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK934968
Chemical Name: 1-(2-chloro-9H-purin-6-yl)-N-[(2E)-1,3,4-thiadiazol-2(3H)-ylidene]piperidine-3-carboxamide
Smiles: O=C(C1CCCN(C1)c1nc(Cl)nc2c1nc[nH]2)/N=c\1/scn[nH]1

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Molecular Weight: 364.82
Empirical Formula: C13H13ClN8OS

Physical State: Dry powder
Available Amount: 323 mg

Lipinsky:
logP: 0.689
Rotatable bonds: 1
H-donors: 2
H-acceptors: 1
PSA: 136
Number of rings: 4

     

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