Standard InChI: InChI=1S/C16H13ClFNO3S/c1-5-9(4)23-13-7-12(11(18)6-10(13)17)19-15(20)14(8(2)3)22-16(19)21/h1,6-7,9H,2-4H3
Standard InChI Key: NCPWAAXDTZXBCV-UHFFFAOYSA-N
Associated Targets(non-human)
Elatine triandra 342 Activities
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Rotala indica 446 Activities
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Echinochloa oryzicola 1513 Activities
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Oryza sativa 2923 Activities
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Zea mays 820 Activities
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Chenopodium album 769 Activities
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Amaranthus viridis 153 Activities
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Digitaria ciliaris 285 Activities
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Echinochloa crus-galli 3685 Activities
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Schoenoplectiella juncoides 1014 Activities
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Pontederia vaginalis 622 Activities
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Lindernia procumbens 387 Activities
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Cyperus difformis 556 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
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Properties
Molecular Weight: 353.80
Molecular Weight (Monoisotopic): 353.0289
AlogP: 4.37
#Rotatable Bonds: 3
Polar Surface Area: 46.61
Molecular Species: NEUTRAL
HBA: 4
HBD: 0
#RO5 Violations: 0
HBA (Lipinski): 4
HBD (Lipinski): 0
#RO5 Violations (Lipinski): 0
CX Acidic pKa:
CX Basic pKa:
CX LogP: 4.13
CX LogD: 4.13
Aromatic Rings: 1
Heavy Atoms: 23
QED Weighted: 0.46
Np Likeness Score: -0.76
References
1.HIRAI K, YANO T, MATSUKAWA T, UGAI S, NAGATO S, HORI M. (1999) Synthesis and Herbicidal Activity of New Oxazolidinedione Derivatives, 24 (2):[10.1584/jpestics.24.156]
