COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK261991
Chemical Name: (4Z)-2-(1,3-benzothiazol-2-yl)-4-(1-{[2-(4-hydroxyphenyl)ethyl]amino}ethylidene)-5-propyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: CCCC1=NN(C(=O)/C/1=C(\NCCc1ccc(cc1)O)/C)c1nc2c(s1)cccc2

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Molecular Weight: 420.54
Empirical Formula: C23H24N4O2S

Physical State: Dry powder
Available Amount: 418 mg

Lipinsky:
logP: 4.758
Rotatable bonds: 5
H-donors: 2
H-acceptors: 2
PSA: 106
Number of rings: 4

     

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