COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK375009
Chemical Name: 2-(1'-acetyl-5',6'-dimethoxy-2',3',8',8a'-tetrahydro-1'H,4H-spiro[cyclohexa-2,5-diene-1,7'-cyclopenta[ij]isoquinolin]-4-ylidene)hydrazinecarbothioamide
Smiles: COc1c(OC)cc2c3c1C1(C=C/C(=N/NC(=S)N)/C=C1)CC3N(CC2)C(=O)C

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Molecular Weight: 412.51
Empirical Formula: C21H24N4O3S

Physical State: Dry powder
Available Amount: 17 mg

Lipinsky:
logP: 1.662
Rotatable bonds: 2
H-donors: 3
H-acceptors: 3
PSA: 121
Number of rings: 4

     

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