COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK010501
Chemical Name: 2-(1,3-benzothiazol-2-yl)-4-{(1E)-N-[2-(morpholin-4-yl)ethyl]ethanimidoyl}-5-propyl-1,2-dihydro-3H-pyrazol-3-one
Smiles: CCCc1[nH]n(c(=O)c1/C(=N/CCN1CCOCC1)/C)c1nc2c(s1)cccc2

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Molecular Weight: 413.54
Empirical Formula: C21H27N5O2S

Physical State: Dry powder
Available Amount: 445 mg

Lipinsky:
logP: 3.498
Rotatable bonds: 5
H-donors: 1
H-acceptors: 2
PSA: 98
Number of rings: 4

     

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