Standard InChI: InChI=1S/C25H46P.ClH/c1-5-7-8-9-10-11-12-13-14-15-16-17-22-26(3,4)23-25-20-18-24(6-2)19-21-25;/h18-21H,5-17,22-23H2,1-4H3;1H/q+1;/p-1
Standard InChI Key: UXFMBACSHMFWOH-UHFFFAOYSA-M
Associated Targets(non-human)
Escherichia coli 133304 Activities
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Staphylococcus aureus 210822 Activities
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Trichoderma harzianum 66 Activities
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Rhizopus stolonifer 28 Activities
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Penicillium citrinum 522 Activities
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Geotrichum candidum 421 Activities
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Debaryomyces hansenii 127 Activities
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Pseudomonas aeruginosa 123386 Activities
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Klebsiella aerogenes 4963 Activities
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Bacillus spizizenii 1898 Activities
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Molecule Features
Natural Product: No
Oral: No
Chemical Probe: No
Parenteral: No
Molecule Type: Small molecule
Topical: No
First In Class: No
Black Box: No
Chirality: No
Availability: No
Prodrug: No
Drug Indications
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Properties
Molecular Weight: 377.62
Molecular Weight (Monoisotopic): 377.3332
AlogP: 8.73
#Rotatable Bonds: 16
Polar Surface Area: 0.00
Molecular Species: NEUTRAL
HBA: 0
HBD: 0
#RO5 Violations: 1
HBA (Lipinski): 0
HBD (Lipinski): 0
#RO5 Violations (Lipinski): 1
CX Acidic pKa:
CX Basic pKa:
CX LogP: 8.94
CX LogD: 8.94
Aromatic Rings: 1
Heavy Atoms: 26
QED Weighted: 0.20
Np Likeness Score: 0.02
References
1.Kanazawa A, Ikeda T, Endo T.. (1994) Synthesis and antimicrobial activity of dimethyl- and trimethyl-substituted phosphonium salts with alkyl chains of various lengths., 38 (5):[PMID:8067774][10.1128/aac.38.5.945]
