COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL445079
Chemical Name: 8-methoxy-4,4-dimethyl-6-({[5-(prop-2-en-1-ylamino)-1,3,4-thiadiazol-2-yl]sulfanyl}methyl)-4H-pyrrolo[3,2,1-ij]quinoline-1,2-dione
Smiles: C=CCNc1nnc(s1)SCC1=CC(C)(C)N2c3c1cc(OC)cc3C(=O)C2=O

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Molecular Weight: 428.54
Empirical Formula: C20H20N4O3S2

Physical State: Dry powder
Available Amount: 30 mg

Lipinsky:
logP: 3.778
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 137
Number of rings: 4

     

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