Entry |
|
Name |
Acorafloxacin hydrochloride (USAN); Avarofloxacin hydrochloride |
Formula |
C21H23F2N3O4. HCl
|
Exact mass |
455.1423
|
Mol weight |
455.8828
|
Structure |
|
Simcomp |
|
Class |
|
Remark |
|
Efficacy |
Antibacterial, Nucleic acid biosynthesis inhibitor |
Comment |
Fluoroquinolones
|
Target |
|
Interaction |
|
Brite |
Drug groups [BR:br08330]
Antibacterial
DG01550 Quinolone
DG01549 Fluoroquinolone
DG01626 Acorafloxacin
D10544 Acorafloxacin hydrochloride
Antimicrobials [BR:br08307]
Antibacterials
Nucleic acid synthesis inhibitor
Fluoroquinolone
D10544 Acorafloxacin hydrochloride (USAN)
Drug groups [BR:br08330]
Antibacterial
DG01550 Quinolone
DG01549 Fluoroquinolone
DG01626 Acorafloxacin
|
Other DBs |
|
KCF data |
ATOM 31
1 C8y C 10.7800 -14.6300
2 O2a O 12.0400 -16.7300
3 C1y C 14.4900 -16.7300
4 C8y C 12.0400 -15.3300
5 C8y C 10.7800 -13.2300
6 C8x C 12.0400 -12.5300
7 N4y N 14.4900 -15.3300
8 C8y C 13.2300 -14.6300
9 C8y C 13.2300 -13.3000
10 C8y C 14.4900 -12.6000
11 C8y C 15.6800 -13.2300
12 C8x C 15.6800 -14.6300
13 C6a C 16.8700 -12.5300
14 O6a O 16.8700 -11.1300
15 O6a O 18.1300 -13.2300
16 O5x O 14.4900 -11.2000
17 X F 9.5900 -12.5300
18 C1x C 13.7900 -17.9200
19 C1x C 15.1900 -17.9200
20 N1y N 9.5900 -15.3300
21 C1x C 9.5900 -16.7300
22 C1x C 8.4000 -17.4300
23 C1x C 7.1400 -16.7300
24 C2y C 7.1400 -15.3300
25 C1x C 8.4000 -14.6300
26 C1a C 10.7800 -17.4300
27 C2c C 5.9500 -14.6300
28 X F 4.6900 -15.2600
29 C1b C 5.9500 -13.2300
30 N1a N 4.7600 -12.5300
31 X Cl 17.9900 -17.6400
BOND 33
1 1 5 1
2 5 6 2
3 6 9 1
4 2 4 1
5 7 3 1
6 7 8 1
7 8 9 2
8 9 10 1
9 10 11 1
10 11 12 2
11 12 7 1
12 11 13 1
13 13 14 2
14 13 15 1
15 10 16 2
16 8 4 1
17 5 17 1
18 4 1 2
19 18 19 1
20 19 3 1
21 18 3 1
22 1 20 1
23 20 21 1
24 21 22 1
25 22 23 1
26 23 24 1
27 24 25 1
28 20 25 1
29 2 26 1
30 24 27 2
31 27 28 1
32 27 29 1
33 29 30 1
|