COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK336216
Chemical Name: N-[(5-{[2-(1,3-benzothiazol-2-ylamino)-2-oxoethyl]sulfanyl}-4-methyl-4H-1,2,4-triazol-3-yl)methyl]-1,3-benzodioxole-5-carboxamide
Smiles: O=C(Nc1nc2c(s1)cccc2)CSc1nnc(n1C)CNC(=O)c1ccc2c(c1)OCO2

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Molecular Weight: 482.54
Empirical Formula: C21H18N6O4S2

Physical State: Dry powder
Available Amount: 81 mg

Lipinsky:
logP: 2.636
Rotatable bonds: 6
H-donors: 2
H-acceptors: 4
PSA: 173
Number of rings: 5

     

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