COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK535782
Chemical Name: [(3-benzyl-7'-nitro-5'H-spiro[cyclohepta[d][1,3]thiazol-3-ium-2,8'-quinolin]-5'-ylidene)(oxido)-lambda~5~-azanyl]oxidanide
Smiles: [O-][N+](=C1C=C([N+](=O)[O-])C2(c3c1cccn3)SC1=CC=CC=CC1=[N+]2Cc1ccccc1)[O-]

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Molecular Weight: 444.47
Empirical Formula: C23H16N4O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0
Rotatable bonds: 1
H-donors: 0
H-acceptors: 4
PSA: 138
Number of rings: 5

     

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