COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL402273
Chemical Name: N-(3-cyano-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophen-2-yl)-3-[(4-nitro-1H-pyrazol-1-yl)methyl]benzamide
Smiles: N#Cc1c(NC(=O)c2cccc(c2)Cn2ncc(c2)[N+](=O)[O-])sc2c1CCCCCCCCCC2

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Molecular Weight: 491.61
Empirical Formula: C26H29N5O3S

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 7.45
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 144
Number of rings: 4

     

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