COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK936777
Chemical Name: 6-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)-N-[(2Z)-5-(propan-2-yl)-1,3,4-thiadiazol-2(3H)-ylidene]hexanamide
Smiles: O=C(/N=c\1/[nH]nc(s1)C(C)C)CCCCCn1nnc2c(c1=O)cccc2

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Molecular Weight: 386.48
Empirical Formula: C18H22N6O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.901
Rotatable bonds: 7
H-donors: 1
H-acceptors: 2
PSA: 124
Number of rings: 3

     

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