Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
J ANTIINFECTIVES FOR SYSTEMIC USE
J05 ANTIVIRALS FOR SYSTEMIC USE
J05A DIRECT ACTING ANTIVIRALS
J05AX Other antivirals
J05AX31 Lenacapavir
D12162 Lenacapavir sodium (JAN/USAN) <US>
Drug groups [BR:br08330]
Metabolizing enzyme substrate
DG01633 CYP3A/CYP3A4 substrate
DG03165 Lenacapavir
D12162 Lenacapavir sodium
DG02924 UGT substrate
DG03183 UGT1A1 substrate
DG03165 Lenacapavir
D12162 Lenacapavir sodium
Transporter substrate
DG01665 ABCB1 substrate
DG03165 Lenacapavir
D12162 Lenacapavir sodium
Antimicrobials [BR:br08307]
Antivirals
Entry, fusion or uncoating inhibitor
HIV core protein inhibitor
D12162 Lenacapavir sodium (JAN/USAN) <US>
New drug approvals in the USA [br08319.html]
New molecular entities and new therapeutic biological products
D12162
New drug approvals in Europe [br08329.html]
European public assessment reports (EPAR) authorised medicine
D12162
New drug approvals in the USA, Europe and Japan [br08328.html]
Approval dates by FDA, EMA and PMDA
D12162
Drug metabolizing enzymes and transporters [br08309.html]
Drug metabolizing enzymes
D12162
Drug transporters
D12162
Drug groups [BR:br08330]
Metabolizing enzyme substrate
DG01633 CYP3A/CYP3A4 substrate
DG03165 Lenacapavir
DG02924 UGT substrate
DG03183 UGT1A1 substrate
DG03165 Lenacapavir
Transporter substrate
DG01665 ABCB1 substrate
DG03165 Lenacapavir
Other DBs
CAS:
2283356-12-5
LinkDB
KCF data
ATOM 65
1 C8y C 24.1006 -13.5215
2 C8x C 22.9096 -14.2221
3 C8y C 22.9096 -15.6233
4 C8x C 24.1706 -16.3239
5 C8y C 25.3616 -15.6233
6 C8x C 25.3616 -14.1521
7 C1b C 21.7185 -16.3239
8 C1c C 20.5275 -15.6934
9 C8y C 19.2664 -16.3940
10 N5x N 18.0754 -15.7635
11 C8y C 16.8844 -16.4640
12 C8x C 16.8844 -17.8652
13 C8x C 18.0754 -18.4958
14 C8y C 19.2664 -17.7952
15 N1b N 20.4575 -14.2922
16 C5a C 19.2664 -13.5916
17 C1b C 19.2664 -12.2605
18 O5a O 18.0754 -14.3623
19 C3b C 15.6233 -15.7635
20 C3b C 14.4323 -15.0629
21 C1d C 13.1712 -14.3623
22 S4a S 11.9802 -13.7317
23 C1a C 13.9419 -13.1712
24 C1a C 12.5407 -15.6233
25 C1a C 10.7191 -13.0311
26 O3c O 12.6808 -12.4706
27 O3c O 11.2796 -14.9227
28 C8y C 20.5275 -18.4257
29 C8y C 20.5275 -19.8269
30 C8y C 21.7886 -20.5275
31 C8y C 22.9796 -19.8269
32 C8x C 22.9796 -18.4257
33 C8x C 21.7185 -17.7251
34 X Cl 24.1706 -20.5275
35 N4y N 19.5467 -20.8078
36 N5x N 20.0371 -22.0688
37 C8y C 21.5084 -21.9287
38 C1b C 18.2155 -20.5976
39 C1d C 17.2347 -21.6485
40 X F 16.3239 -22.6293
41 X F 16.2539 -20.6676
42 X F 18.2155 -22.5593
43 N1b N 22.4892 -22.9796 #-
44 S4a S 22.0688 -24.3107
45 C1a C 21.3682 -25.5018
46 O3c O 20.8778 -23.6802
47 O3c O 23.2598 -25.0113
48 X F 26.6227 -16.2539
49 X F 24.1006 -12.1203
50 N4y N 18.0754 -11.5599
51 C8y C 18.0754 -10.1587
52 C8y C 16.7443 -9.7383
53 C8y C 15.9036 -10.8593
54 N5x N 16.6742 -11.9802
55 C1z C 18.9161 -9.0377
56 C1y C 18.0754 -7.8467
57 C1y C 16.7443 -8.3371
58 X F 20.3173 -9.0377
59 X F 19.5467 -10.2988
60 C1x C 17.0245 -6.9359
61 C1d C 14.5024 -10.8593
62 X F 13.1012 -10.8593
63 X F 14.5024 -9.4581
64 X F 14.5024 -12.2605
65 Z Na 25.7600 -22.8900 #+
BOND 70
1 1 2 2
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 2
6 1 6 1
7 3 7 1
8 7 8 1
9 8 9 1
10 9 10 1
11 10 11 2
12 11 12 1
13 12 13 2
14 13 14 1
15 9 14 2
16 8 15 1 #Up
17 15 16 1
18 16 17 1
19 16 18 2
20 11 19 1
21 19 20 3
22 20 21 1
23 21 22 1
24 21 23 1
25 21 24 1
26 22 25 1
27 22 26 2
28 22 27 2
29 14 28 1
30 28 29 1
31 29 30 2
32 30 31 1
33 31 32 2
34 32 33 1
35 28 33 2
36 31 34 1
37 29 35 1
38 35 36 1
39 36 37 2
40 30 37 1
41 35 38 1
42 38 39 1
43 39 40 1
44 39 41 1
45 39 42 1
46 37 43 1
47 43 44 1
48 44 45 1
49 44 46 2
50 44 47 2
51 5 48 1
52 1 49 1
53 17 50 1
54 50 51 1
55 51 52 2
56 52 53 1
57 53 54 2
58 50 54 1
59 51 55 1
60 55 56 1
61 56 57 1
62 52 57 1
63 55 58 1
64 55 59 1
65 56 60 1
66 60 57 1
67 53 61 1
68 61 62 1
69 61 63 1
70 61 64 1
