COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK336225
Chemical Name: N-{1-[5-{[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]sulfanyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]ethyl}furan-2-carboxamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc3c(c2)OCO3)nnc1C(NC(=O)c1ccco1)C

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Molecular Weight: 455.49
Empirical Formula: C21H21N5O5S

Physical State: Dry powder
Available Amount: 98 mg

Lipinsky:
logP: 3.141
Rotatable bonds: 8
H-donors: 2
H-acceptors: 5
PSA: 145
Number of rings: 4

     

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