COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL268528
Chemical Name: N-ethyl-1-[(4-nitrophenoxy)methyl]-4-phenyl-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulene-3-carbothioamide
Smiles: CCNC(=S)c1c(c2ccccc2)c2c3n1nc(n3CCCC2)COc1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 475.57
Empirical Formula: C25H25N5O3S

Available Amount: 0 mg

Lipinsky:
logP: 5.252
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 121
Number of rings: 5

     

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