COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK142369
Chemical Name: N-cyclopentyl-N~2~-[3-(3,5-di-tert-butyl-4-hydroxyphenyl)propanoyl]-N~2~-(thiophen-2-ylmethyl)isovalinamide
Smiles: CCC(N(C(=O)CCc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)Cc1cccs1)(C(=O)NC1CCCC1)C

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Molecular Weight: 540.81
Empirical Formula: C32H48N2O3S

Physical State: Dry powder
Available Amount: 92 mg

Lipinsky:
logP: 7.338
Rotatable bonds: 9
H-donors: 2
H-acceptors: 3
PSA: 97
Number of rings: 3

     

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