| Entry |
| ||||||
|---|---|---|---|---|---|---|---|
| Name | Islatravir (USAN) | ||||||
| Formula | C12H12FN5O3 | ||||||
| Exact mass | 293.0924 | ||||||
| Mol weight | 293.2538 | ||||||
| Structure |  | ||||||
| Simcomp | |||||||
| Remark |
| ||||||
| Efficacy | Antiviral, Reverse transcriptase inhibitor | ||||||
| Target | HIV-1 reverse transcriptase [KO:K24802] | ||||||
| Pathway |
| ||||||
| Brite | Antimicrobials [BR:br08307] Antivirals Genome replication inhibitor HIV reverse transcriptase inhibitor D11432 Islatravir (USAN) | ||||||
| Other DBs |
| ||||||
| KCF data | ATOM 21 1 N4y N 19.3200 -15.4000 2 C8y C 20.5100 -16.2400 3 C1y C 17.9900 -15.8200 4 C8x C 19.8100 -14.0700 5 C8y C 21.6300 -15.4000 6 N5x N 20.6500 -17.7100 7 O2x O 16.8000 -14.9800 8 C1x C 17.5000 -17.2200 9 N5x N 21.2100 -14.0700 10 C8y C 22.8900 -15.9600 11 C8y C 21.9100 -18.2700 12 C1z C 15.6800 -15.8200 13 C1y C 16.1000 -17.2200 14 N5x N 23.0300 -17.4300 15 N1a N 24.0100 -15.1900 16 O1a O 15.3300 -18.3400 17 C1b C 14.4900 -15.1200 18 O1a O 13.3000 -15.8200 19 C3b C 14.4900 -16.5200 20 C3a C 13.2300 -17.2200 21 X F 22.0500 -19.6700 BOND 23 1 1 2 1 2 3 1 1 #Up 3 1 4 1 4 2 5 2 5 2 6 1 6 3 7 1 7 3 8 1 8 4 9 2 9 5 10 1 10 6 11 2 11 7 12 1 12 8 13 1 13 10 14 2 14 10 15 1 15 13 16 1 #Down 16 5 9 1 17 11 14 1 18 12 13 1 19 12 17 1 #Up 20 17 18 1 21 12 19 1 #Down 22 19 20 3 23 11 21 1 |