COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK934629
Chemical Name: 4-(3-chlorophenyl)-N-(2-{[(2Z)-5-(methoxymethyl)-1,3,4-thiadiazol-2(3H)-ylidene]amino}-2-oxoethyl)piperazine-1-carboxamide
Smiles: COCc1n[nH]/c(=N/C(=O)CNC(=O)N2CCN(CC2)c2cccc(c2)Cl)/s1

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Molecular Weight: 424.91
Empirical Formula: C17H21ClN6O3S

Physical State: Dry powder
Available Amount: 310 mg

Lipinsky:
logP: 1.062
Rotatable bonds: 4
H-donors: 2
H-acceptors: 3
PSA: 123
Number of rings: 3

     

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