Standard InChI: InChI=1S/C20H20Br2N4OS2/c1-13-3-5-14(6-4-13)10-28-11-18-24-25-20(26(18)2)29-12-19(27)23-17-8-7-15(21)9-16(17)22/h3-9H,10-12H2,1-2H3,(H,23,27)
Potassium channel subfamily K member 2 490 Activities
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Relation
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Molecule Features
Natural Product: No
Oral: No
Chemical Probe: No
Parenteral: No
Molecule Type:
Topical: No
First In Class: No
Black Box: No
Chirality: No
Availability: No
Prodrug: No
Drug Indications
MESH ID
MESH Heading
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Max Phase for Indication
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Mechanisms of Action
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Binding Site Name
References
Properties
Molecular Weight: 556.35
Molecular Weight (Monoisotopic): 553.9445
AlogP: 5.81
#Rotatable Bonds: 8
Polar Surface Area: 59.81
Molecular Species: NEUTRAL
HBA: 6
HBD: 1
#RO5 Violations: 2
HBA (Lipinski): 5
HBD (Lipinski): 1
#RO5 Violations (Lipinski): 2
CX Acidic pKa: 12.53
CX Basic pKa: 1.20
CX LogP: 5.44
CX LogD: 5.44
Aromatic Rings: 3
Heavy Atoms: 29
QED Weighted: 0.36
Np Likeness Score: -2.39
References
1.Liu S, Guo P, Wang K, Zhang S, Li Y, Shen J, Mei L, Ye Y, Zhang Q, Yang H.. (2022) General Pharmacological Activation Mechanism of K+ Channels Bypassing Channel Gates., 65 (15.0):[PMID:35878013][10.1021/acs.jmedchem.1c02115]
