COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL448693
Chemical Name: (3Z)-3-({1-[4-(cyclohexylamino)-3-nitrophenyl]-2,5-dimethyl-1H-pyrrol-3-yl}methylidene)-1-ethyl-5-(morpholin-4-ylsulfonyl)-1,3-dihydro-2H-indol-2-one
Smiles: CCN1C(=O)/C(=C\c2cc(n(c2C)c2ccc(c(c2)[N+](=O)[O-])NC2CCCCC2)C)/c2c1ccc(c2)S(=O)(=O)N1CCOCC1

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Molecular Weight: 633.77
Empirical Formula: C33H39N5O6S

Physical State: Dry powder
Available Amount: 36 mg

Lipinsky:
logP: 6.884
Rotatable bonds: 4
H-donors: 1
H-acceptors: 6
PSA: 138
Number of rings: 6

     

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