COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK507121
Chemical Name: N-{[5-{[2-(1,3-benzothiazol-2-ylamino)-2-oxoethyl]sulfanyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]methyl}thiophene-2-carboxamide
Smiles: C=CCn1c(SCC(=O)Nc2nc3c(s2)cccc3)nnc1CNC(=O)c1cccs1

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Molecular Weight: 470.6
Empirical Formula: C20H18N6O2S3

Physical State: Dry powder
Available Amount: 94 mg

Lipinsky:
logP: 3.932
Rotatable bonds: 8
H-donors: 2
H-acceptors: 2
PSA: 183
Number of rings: 4

     

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