COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK137753
Chemical Name: N-{1-[5-{[2-(1,3-benzothiazol-2-ylamino)-2-oxoethyl]sulfanyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]-2-methylpropyl}benzamide
Smiles: C=CCn1c(SCC(=O)Nc2nc3c(s2)cccc3)nnc1C(C(C)C)NC(=O)c1ccccc1

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Molecular Weight: 506.65
Empirical Formula: C25H26N6O2S2

Physical State: Dry powder
Available Amount: 214 mg

Lipinsky:
logP: 5.317
Rotatable bonds: 8
H-donors: 2
H-acceptors: 2
PSA: 155
Number of rings: 4

     

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