COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL039004
Chemical Name: 1-[2-(cyclohex-1-en-1-yl)ethyl]-5-({1-[2-(cyclohex-1-en-1-yl)ethyl]-4-hydroxy-6-oxo-2-sulfanyl-1,6-dihydropyrimidin-5-yl}[4-methoxy-3-(piperidinium-1-ylmethyl)phenyl]methyl)-4-hydroxy-6-oxo-1,6-dihydr
Smiles: COc1ccc(cc1C[NH+]1CCCCC1)C(c1c(O)nc(n(c1=O)CCC1=CCCCC1)S)c1c(O)nc(n(c1=O)CCC1=CCCCC1)[S-]

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Molecular Weight: 719.97
Empirical Formula: C38H49N5O5S2

Physical State: Dry powder
Available Amount: 147 mg

Lipinsky:
logP: 8.133
Rotatable bonds: 15
H-donors: 3
H-acceptors: 5
PSA: 158
Number of rings: 6

     

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