Target ID | Target Type | Target Name | Target Organism | Activity Type | Activity Relation | Value | Unit | Reference |
---|---|---|---|---|---|---|---|---|
NPT375 | Cell Line | Malme-3M | Homo sapiens | GI50 | 2483.13 | nM | 19908867 | |
NPT323 | Cell Line | SW-620 | Homo sapiens | GI50 | 1104.08 | nM | 22413911 | |
NPT398 | Cell Line | UACC-62 | Homo sapiens | GI50 | 5956.62 | nM | 17958396 | |
NPT83 | Cell Line | MCF7 | Homo sapiens | GI50 | 561.05 | nM | 19200744 | |
NPT374 | Cell Line | SF-539 | Homo sapiens | GI50 | 2312.06 | nM | 12542343 | |
NPT82 | Cell Line | MDA-MB-231 | Homo sapiens | GI50 | 7533.56 | nM | 15974612 | |
NPT147 | Cell Line | SK-MEL-2 | Homo sapiens | GI50 | 17498.47 | nM | 26218649 | |
NPT393 | Cell Line | HCT-116 | Homo sapiens | GI50 | 1166.81 | nM | PubChem BioAssay data set | |
NPT404 | Cell Line | CCRF-CEM | Homo sapiens | GI50 | 94.41 | nM | 11689077 | |
NPT385 | Cell Line | SR | Homo sapiens | GI50 | 57.81 | nM | 1282538 | |
NPT392 | Cell Line | SNB-75 | Homo sapiens | GI50 | 10568.18 | nM | PubChem BioAssay data set | |
NPT377 | Cell Line | OVCAR-3 | Homo sapiens | GI50 | 6338.7 | nM | 7562925 | |
NPT389 | Cell Line | RPMI-8226 | Homo sapiens | GI50 | 2023.02 | nM | 11012023 | |
NPT383 | Cell Line | SNB-19 | Homo sapiens | GI50 | 12589.25 | nM | 17049255 | |
NPT183 | Individual Protein | Arachidonate 5-lipoxygenase | Rattus norvegicus | Inhibition | = | 16.4 | % | PubChem BioAssay data set |
NPT368 | Cell Line | SN12C | Homo sapiens | GI50 | 1588.55 | nM | 25148392 | |
NPT116 | Cell Line | HL-60 | Homo sapiens | GI50 | 128.82 | nM | 19902967 | |
NPT308 | Cell Line | CAKI-1 | Homo sapiens | GI50 | 1380.38 | nM | 10.6019/CHEMBL1201861 | |
NPT183 | Individual Protein | Arachidonate 5-lipoxygenase | Rattus norvegicus | IC50 | > | 200000 | nM | 15921441 |
NPT2 | Others | Unspecified | IC50 | > | 200000 | nM | 18053715 | |
NPT395 | Cell Line | SF-268 | Homo sapiens | GI50 | 14092.89 | nM | 16252913 | |
NPT457 | Cell Line | BT-549 | Homo sapiens | GI50 | 2449.06 | nM | 18973387 | |
NPT170 | Cell Line | SK-MEL-28 | Homo sapiens | GI50 | 2747.89 | nM | PubChem BioAssay data set | |
NPT369 | Cell Line | ACHN | Homo sapiens | GI50 | 2182.73 | nM | 25211032 | |
NPT367 | Cell Line | MDA-N | Homo sapiens | GI50 | 1202.26 | nM | 11975483 | |
NPT400 | Cell Line | MDA-MB-435 | Homo sapiens | GI50 | 1425.61 | nM | 23911853 | |
NPT373 | Cell Line | SK-MEL-5 | Homo sapiens | GI50 | 2837.92 | nM | 19658408 | |
NPT146 | Cell Line | SK-OV-3 | Homo sapiens | GI50 | 20276.83 | nM | 2724308 | |
NPT139 | Cell Line | HT-29 | Homo sapiens | GI50 | 2443.43 | nM | 20850303 | |
NPT378 | Cell Line | NCI/ADR-RES | Homo sapiens | GI50 | 4528.98 | nM | 18725447 | |
NPT399 | Cell Line | SF-295 | Homo sapiens | GI50 | 15523.87 | nM | 10.1007/s00044-010-9388-0 | |
NPT406 | Cell Line | RXF 393 | Homo sapiens | GI50 | 1845.02 | nM | 15646539 | |
NPT386 | Cell Line | KM12 | Homo sapiens | GI50 | 14962.36 | nM | PubChem BioAssay data set | |
NPT380 | Cell Line | U-251 | Homo sapiens | GI50 | 6792.04 | nM | 23855338 | |
NPT376 | Cell Line | A498 | Homo sapiens | GI50 | 8590.14 | nM | 24012119 | |
NPT455 | Cell Line | NCI-H522 | Homo sapiens | GI50 | 438.53 | nM | 11858759 | |
NPT384 | Cell Line | TK-10 | Homo sapiens | GI50 | 3126.08 | nM | 17685651 | |
NPT394 | Cell Line | EKVX | Homo sapiens | GI50 | 7447.32 | nM | 10.1039/C1MD00003A | |
NPT388 | Cell Line | NCI-H322M | Homo sapiens | GI50 | 21183.61 | nM | 3735324 | |
NPT371 | Cell Line | UO-31 | Homo sapiens | GI50 | 2624.22 | nM | 20568785 | |
NPT306 | Cell Line | PC-3 | Homo sapiens | GI50 | 9141.13 | nM | 24094434 | |
NPT397 | Cell Line | NCI-H460 | Homo sapiens | GI50 | 2618.18 | nM | 24571273 | |
NPT381 | Cell Line | OVCAR-8 | Homo sapiens | GI50 | 4698.94 | nM | 20065051 | |
NPT382 | Cell Line | OVCAR-5 | Homo sapiens | GI50 | 9462.37 | nM | 20160056 | |
NPT2 | Others | Unspecified | Inhibition | = | 9.5 | % | 21135175 | |
NPT139 | Cell Line | HT-29 | Homo sapiens | ED50 | = | 3.6 | ug/ml | 21199921 |
NPT81 | Cell Line | A549 | Homo sapiens | ED50 | = | 3.8 | ug/ml | 19564359 |
NPT401 | Cell Line | 786-0 | Homo sapiens | GI50 | 974.99 | nM | 23634786 | |
NPT90 | Cell Line | DU-145 | Homo sapiens | GI50 | 3162.28 | nM | 24582402 | |
NPT403 | Cell Line | UACC-257 | Homo sapiens | GI50 | 4655.86 | nM | 19805565 | |
NPT387 | Cell Line | M14 | Homo sapiens | GI50 | 3689.78 | nM | 21397370 | |
NPT391 | Cell Line | HCC 2998 | Homo sapiens | GI50 | 3396.25 | nM | 15568791 | |
NPT111 | Cell Line | K562 | Homo sapiens | GI50 | 1815.52 | nM | 16933872 | |
NPT405 | Cell Line | NCI-H226 | Homo sapiens | GI50 | 14791.08 | nM | 22804108 | |
NPT168 | Cell Line | P388 | Mus musculus | ED50 | = | 4.6 | ug/ml | 15711537 |
NPT458 | Cell Line | IGROV-1 | Homo sapiens | GI50 | 3258.37 | nM | 24582402 | |
NPT148 | Cell Line | HCT-15 | Homo sapiens | GI50 | 688.65 | nM | 15026054 | |
NPT456 | Cell Line | OVCAR-4 | Homo sapiens | GI50 | 743.02 | nM | 24679044 | |
NPT407 | Cell Line | COLO 205 | Homo sapiens | GI50 | 1803.02 | nM | 19687238 | |
NPT81 | Cell Line | A549 | Homo sapiens | GI50 | 13899.53 | nM | DrugMatrix in vivo data: Pathology | |
NPT372 | Cell Line | HOP-92 | Homo sapiens | GI50 | 1972.42 | nM | 26948407 | |
NPT396 | Cell Line | T47D | Homo sapiens | GI50 | 2306.75 | nM | 16420055 | |
NPT379 | Cell Line | HOP-62 | Homo sapiens | GI50 | 15346.17 | nM | 8289059 | |
NPT112 | Cell Line | MOLT-4 | Homo sapiens | GI50 | 184.5 | nM | 19072214 | |
NPT370 | Cell Line | NCI-H23 | Homo sapiens | GI50 | 5199.96 | nM | 8133293 | |
NPT390 | Cell Line | LOX IMVI | Homo sapiens | GI50 | 1174.9 | nM | 24025124 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules. Tc lies between [0, 1] where '1' indicates the highest similarity. What is Tanimoto coefficient
●  The left chart: Distribution of similarity level between NPC285594 and all remaining natural products in the NPASS database.
●  The right table: Most similar natural products (Tc>=0.56 or Top200).
Similarity Score | Similarity Level | Natural Product ID |
---|---|---|
1.0 | High Similarity | NPC96551 |
0.85 | High Similarity | NPC25853 |
0.8475 | Intermediate Similarity | NPC266295 |
0.8475 | Intermediate Similarity | NPC94991 |
0.8475 | Intermediate Similarity | NPC30215 |
0.8387 | Intermediate Similarity | NPC6697 |
0.8387 | Intermediate Similarity | NPC475124 |
0.8333 | Intermediate Similarity | NPC259261 |
0.8305 | Intermediate Similarity | NPC115385 |
0.8226 | Intermediate Similarity | NPC165695 |
0.8197 | Intermediate Similarity | NPC127582 |
0.8167 | Intermediate Similarity | NPC308108 |
0.8167 | Intermediate Similarity | NPC170799 |
0.8095 | Intermediate Similarity | NPC212210 |
0.8065 | Intermediate Similarity | NPC475795 |
0.8065 | Intermediate Similarity | NPC213152 |
0.8065 | Intermediate Similarity | NPC97322 |
0.8 | Intermediate Similarity | NPC267626 |
0.8 | Intermediate Similarity | NPC193695 |
0.8 | Intermediate Similarity | NPC49575 |
0.8 | Intermediate Similarity | NPC55004 |
0.8 | Intermediate Similarity | NPC230823 |
0.7969 | Intermediate Similarity | NPC251118 |
0.7966 | Intermediate Similarity | NPC275472 |
0.7937 | Intermediate Similarity | NPC167256 |
0.7937 | Intermediate Similarity | NPC288253 |
0.7937 | Intermediate Similarity | NPC32285 |
0.7931 | Intermediate Similarity | NPC268564 |
0.7931 | Intermediate Similarity | NPC296311 |
0.7931 | Intermediate Similarity | NPC474141 |
0.7895 | Intermediate Similarity | NPC27438 |
0.7869 | Intermediate Similarity | NPC56905 |
0.7869 | Intermediate Similarity | NPC311852 |
0.7869 | Intermediate Similarity | NPC27610 |
0.7833 | Intermediate Similarity | NPC20603 |
0.7812 | Intermediate Similarity | NPC473902 |
0.7812 | Intermediate Similarity | NPC285371 |
0.7797 | Intermediate Similarity | NPC63396 |
0.7797 | Intermediate Similarity | NPC202850 |
0.7746 | Intermediate Similarity | NPC211279 |
0.7742 | Intermediate Similarity | NPC472304 |
0.7742 | Intermediate Similarity | NPC143834 |
0.7742 | Intermediate Similarity | NPC276764 |
0.7727 | Intermediate Similarity | NPC475523 |
0.7719 | Intermediate Similarity | NPC32351 |
0.7705 | Intermediate Similarity | NPC192427 |
0.7692 | Intermediate Similarity | NPC470329 |
0.7627 | Intermediate Similarity | NPC23117 |
0.7612 | Intermediate Similarity | NPC87141 |
0.7612 | Intermediate Similarity | NPC310992 |
0.7612 | Intermediate Similarity | NPC188292 |
0.7612 | Intermediate Similarity | NPC260474 |
0.7612 | Intermediate Similarity | NPC155198 |
0.7586 | Intermediate Similarity | NPC64866 |
0.7586 | Intermediate Similarity | NPC236623 |
0.7544 | Intermediate Similarity | NPC145311 |
0.75 | Intermediate Similarity | NPC61702 |
0.75 | Intermediate Similarity | NPC162867 |
0.75 | Intermediate Similarity | NPC60565 |
0.75 | Intermediate Similarity | NPC256846 |
0.7458 | Intermediate Similarity | NPC471751 |
0.7432 | Intermediate Similarity | NPC304795 |
0.7414 | Intermediate Similarity | NPC228776 |
0.7414 | Intermediate Similarity | NPC176819 |
0.7414 | Intermediate Similarity | NPC116906 |
0.7414 | Intermediate Similarity | NPC163984 |
0.7414 | Intermediate Similarity | NPC58970 |
0.7397 | Intermediate Similarity | NPC321180 |
0.7391 | Intermediate Similarity | NPC265782 |
0.7391 | Intermediate Similarity | NPC2634 |
0.7391 | Intermediate Similarity | NPC251929 |
0.7385 | Intermediate Similarity | NPC197238 |
0.7385 | Intermediate Similarity | NPC202118 |
0.7377 | Intermediate Similarity | NPC200258 |
0.7333 | Intermediate Similarity | NPC14002 |
0.7333 | Intermediate Similarity | NPC45283 |
0.7333 | Intermediate Similarity | NPC37644 |
0.7302 | Intermediate Similarity | NPC60772 |
0.7286 | Intermediate Similarity | NPC54123 |
0.7286 | Intermediate Similarity | NPC21944 |
0.7286 | Intermediate Similarity | NPC474562 |
0.7273 | Intermediate Similarity | NPC150162 |
0.7273 | Intermediate Similarity | NPC109813 |
0.7273 | Intermediate Similarity | NPC469662 |
0.7273 | Intermediate Similarity | NPC60556 |
0.7258 | Intermediate Similarity | NPC473733 |
0.7246 | Intermediate Similarity | NPC139397 |
0.7213 | Intermediate Similarity | NPC5626 |
0.7206 | Intermediate Similarity | NPC290350 |
0.7206 | Intermediate Similarity | NPC4370 |
0.7193 | Intermediate Similarity | NPC236355 |
0.7193 | Intermediate Similarity | NPC4079 |
0.7193 | Intermediate Similarity | NPC14917 |
0.7193 | Intermediate Similarity | NPC262558 |
0.7193 | Intermediate Similarity | NPC8610 |
0.7183 | Intermediate Similarity | NPC303613 |
0.7183 | Intermediate Similarity | NPC251705 |
0.7183 | Intermediate Similarity | NPC470044 |
0.7183 | Intermediate Similarity | NPC474228 |
0.7183 | Intermediate Similarity | NPC470045 |
0.7143 | Intermediate Similarity | NPC260040 |
0.7143 | Intermediate Similarity | NPC307176 |
0.7143 | Intermediate Similarity | NPC282593 |
0.7143 | Intermediate Similarity | NPC159577 |
0.7143 | Intermediate Similarity | NPC35734 |
0.7121 | Intermediate Similarity | NPC472306 |
0.7101 | Intermediate Similarity | NPC469688 |
0.7097 | Intermediate Similarity | NPC188789 |
0.7083 | Intermediate Similarity | NPC474796 |
0.7083 | Intermediate Similarity | NPC309852 |
0.7083 | Intermediate Similarity | NPC20025 |
0.7083 | Intermediate Similarity | NPC329866 |
0.7083 | Intermediate Similarity | NPC474797 |
0.7069 | Intermediate Similarity | NPC91962 |
0.7059 | Intermediate Similarity | NPC197089 |
0.7049 | Intermediate Similarity | NPC69898 |
0.7049 | Intermediate Similarity | NPC295777 |
0.7042 | Intermediate Similarity | NPC225467 |
0.7042 | Intermediate Similarity | NPC234707 |
0.7042 | Intermediate Similarity | NPC190035 |
0.7042 | Intermediate Similarity | NPC181204 |
0.7042 | Intermediate Similarity | NPC115023 |
0.7042 | Intermediate Similarity | NPC5701 |
0.7042 | Intermediate Similarity | NPC133253 |
0.7015 | Intermediate Similarity | NPC4638 |
0.7013 | Intermediate Similarity | NPC145963 |
0.6986 | Remote Similarity | NPC251435 |
0.6986 | Remote Similarity | NPC476346 |
0.6986 | Remote Similarity | NPC293803 |
0.697 | Remote Similarity | NPC260573 |
0.6964 | Remote Similarity | NPC216921 |
0.6944 | Remote Similarity | NPC109576 |
0.6944 | Remote Similarity | NPC56747 |
0.6944 | Remote Similarity | NPC130016 |
0.6944 | Remote Similarity | NPC470237 |
0.6944 | Remote Similarity | NPC180015 |
0.6935 | Remote Similarity | NPC250539 |
0.6935 | Remote Similarity | NPC209431 |
0.6935 | Remote Similarity | NPC100809 |
0.6901 | Remote Similarity | NPC246722 |
0.6901 | Remote Similarity | NPC151045 |
0.6897 | Remote Similarity | NPC100380 |
0.6892 | Remote Similarity | NPC469793 |
0.6892 | Remote Similarity | NPC1254 |
0.6892 | Remote Similarity | NPC469796 |
0.6892 | Remote Similarity | NPC69408 |
0.6892 | Remote Similarity | NPC470525 |
0.6857 | Remote Similarity | NPC39157 |
0.6857 | Remote Similarity | NPC476614 |
0.6857 | Remote Similarity | NPC20610 |
0.6857 | Remote Similarity | NPC82477 |
0.6857 | Remote Similarity | NPC469679 |
0.6857 | Remote Similarity | NPC142754 |
0.6857 | Remote Similarity | NPC296697 |
0.6849 | Remote Similarity | NPC167049 |
0.6849 | Remote Similarity | NPC255021 |
0.6849 | Remote Similarity | NPC469691 |
0.6842 | Remote Similarity | NPC25771 |
0.6833 | Remote Similarity | NPC118788 |
0.6818 | Remote Similarity | NPC40206 |
0.6818 | Remote Similarity | NPC270042 |
0.6812 | Remote Similarity | NPC323005 |
0.6806 | Remote Similarity | NPC304983 |
0.6806 | Remote Similarity | NPC305501 |
0.68 | Remote Similarity | NPC97377 |
0.6765 | Remote Similarity | NPC52449 |
0.6765 | Remote Similarity | NPC169275 |
0.6761 | Remote Similarity | NPC10758 |
0.6761 | Remote Similarity | NPC469677 |
0.6761 | Remote Similarity | NPC286814 |
0.6761 | Remote Similarity | NPC182815 |
0.6761 | Remote Similarity | NPC469914 |
0.6761 | Remote Similarity | NPC250928 |
0.6757 | Remote Similarity | NPC469678 |
0.6757 | Remote Similarity | NPC473171 |
0.6757 | Remote Similarity | NPC255650 |
0.6757 | Remote Similarity | NPC65650 |
0.6757 | Remote Similarity | NPC472256 |
0.6757 | Remote Similarity | NPC114236 |
0.6757 | Remote Similarity | NPC469669 |
0.6757 | Remote Similarity | NPC475771 |
0.6757 | Remote Similarity | NPC77501 |
0.6724 | Remote Similarity | NPC166788 |
0.6721 | Remote Similarity | NPC234829 |
0.6716 | Remote Similarity | NPC294304 |
0.6716 | Remote Similarity | NPC228574 |
0.6714 | Remote Similarity | NPC20181 |
0.6714 | Remote Similarity | NPC220210 |
0.6711 | Remote Similarity | NPC475994 |
0.6711 | Remote Similarity | NPC189485 |
0.6711 | Remote Similarity | NPC228911 |
0.6711 | Remote Similarity | NPC62336 |
0.6711 | Remote Similarity | NPC74410 |
0.6711 | Remote Similarity | NPC115515 |
0.6667 | Remote Similarity | NPC469646 |
0.6667 | Remote Similarity | NPC95581 |
0.6667 | Remote Similarity | NPC268039 |
0.6667 | Remote Similarity | NPC474527 |
0.6667 | Remote Similarity | NPC474304 |
0.6667 | Remote Similarity | NPC471726 |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.
●  The left chart: Distribution of similarity level between NPC285594 and all drugs/candidates.
●  The right table: Most similar clinical/approved drugs (Tc>=0.56 or Top200).
Similarity Score | Similarity Level | Drug ID | Developmental Stage |
---|---|---|---|
0.8167 | Intermediate Similarity | NPD287 | Approved |
0.7391 | Intermediate Similarity | NPD4691 | Approved |
0.7246 | Intermediate Similarity | NPD4137 | Phase 3 |
0.7143 | Intermediate Similarity | NPD4747 | Approved |
0.7083 | Intermediate Similarity | NPD4058 | Approved |
0.7042 | Intermediate Similarity | NPD5276 | Approved |
0.6857 | Remote Similarity | NPD3621 | Clinical (unspecified phase) |
0.6849 | Remote Similarity | NPD4687 | Approved |
0.6849 | Remote Similarity | NPD5733 | Approved |
0.6571 | Remote Similarity | NPD7331 | Phase 2 |
0.6538 | Remote Similarity | NPD4695 | Discontinued |
0.6296 | Remote Similarity | NPD3527 | Clinical (unspecified phase) |
0.625 | Remote Similarity | NPD8028 | Phase 2 |
0.6197 | Remote Similarity | NPD7341 | Phase 2 |
0.6173 | Remote Similarity | NPD4223 | Phase 3 |
0.6173 | Remote Similarity | NPD4221 | Approved |
0.6071 | Remote Similarity | NPD5690 | Phase 2 |
0.6024 | Remote Similarity | NPD3665 | Phase 1 |
0.6024 | Remote Similarity | NPD3133 | Approved |
0.6024 | Remote Similarity | NPD3666 | Approved |
0.6024 | Remote Similarity | NPD4197 | Approved |
0.6 | Remote Similarity | NPD3573 | Approved |
0.5976 | Remote Similarity | NPD4752 | Clinical (unspecified phase) |
0.5965 | Remote Similarity | NPD5783 | Phase 3 |
0.5952 | Remote Similarity | NPD1694 | Approved |
0.5952 | Remote Similarity | NPD5329 | Approved |
0.5915 | Remote Similarity | NPD2664 | Clinical (unspecified phase) |
0.589 | Remote Similarity | NPD6108 | Clinical (unspecified phase) |
0.5882 | Remote Similarity | NPD5205 | Approved |
0.5882 | Remote Similarity | NPD5330 | Approved |
0.5882 | Remote Similarity | NPD7146 | Approved |
0.5882 | Remote Similarity | NPD3574 | Clinical (unspecified phase) |
0.5882 | Remote Similarity | NPD4138 | Approved |
0.5882 | Remote Similarity | NPD7521 | Approved |
0.5882 | Remote Similarity | NPD3618 | Phase 1 |
0.5882 | Remote Similarity | NPD7334 | Approved |
0.5882 | Remote Similarity | NPD4694 | Approved |
0.5882 | Remote Similarity | NPD4623 | Approved |
0.5882 | Remote Similarity | NPD6409 | Approved |
0.5882 | Remote Similarity | NPD5280 | Approved |
0.5882 | Remote Similarity | NPD5279 | Phase 3 |
0.5882 | Remote Similarity | NPD4693 | Phase 3 |
0.5882 | Remote Similarity | NPD4690 | Approved |
0.5882 | Remote Similarity | NPD6684 | Approved |
0.5882 | Remote Similarity | NPD4689 | Approved |
0.5882 | Remote Similarity | NPD4688 | Approved |
0.5882 | Remote Similarity | NPD4519 | Discontinued |
0.5875 | Remote Similarity | NPD3617 | Approved |
0.5875 | Remote Similarity | NPD5784 | Clinical (unspecified phase) |
0.5854 | Remote Similarity | NPD857 | Phase 3 |
0.5821 | Remote Similarity | NPD4627 | Clinical (unspecified phase) |
0.5806 | Remote Similarity | NPD344 | Approved |
0.5806 | Remote Similarity | NPD345 | Approved |
0.5806 | Remote Similarity | NPD343 | Approved |
0.5783 | Remote Similarity | NPD3667 | Approved |
0.5783 | Remote Similarity | NPD5209 | Approved |
0.5775 | Remote Similarity | NPD4191 | Approved |
0.5775 | Remote Similarity | NPD4193 | Approved |
0.5775 | Remote Similarity | NPD4192 | Approved |
0.5775 | Remote Similarity | NPD4194 | Approved |
0.5747 | Remote Similarity | NPD7513 | Clinical (unspecified phase) |
0.5747 | Remote Similarity | NPD6672 | Approved |
0.5747 | Remote Similarity | NPD4518 | Approved |
0.5747 | Remote Similarity | NPD6903 | Approved |
0.5747 | Remote Similarity | NPD5208 | Approved |
0.5747 | Remote Similarity | NPD5737 | Approved |
0.5732 | Remote Similarity | NPD8259 | Clinical (unspecified phase) |
0.573 | Remote Similarity | NPD6079 | Approved |
0.5682 | Remote Similarity | NPD5328 | Approved |
0.5682 | Remote Similarity | NPD6904 | Approved |
0.5682 | Remote Similarity | NPD4753 | Phase 2 |
0.5682 | Remote Similarity | NPD6080 | Approved |
0.5682 | Remote Similarity | NPD6673 | Approved |
0.5647 | Remote Similarity | NPD3668 | Phase 3 |
0.5647 | Remote Similarity | NPD4786 | Approved |
0.5618 | Remote Similarity | NPD5207 | Approved |
0.5618 | Remote Similarity | NPD5785 | Approved |
0.5618 | Remote Similarity | NPD4096 | Approved |
0.5618 | Remote Similarity | NPD5692 | Phase 3 |
0.561 | Remote Similarity | NPD4195 | Approved |
PubChem CID   | 5352042 |
ChEMBL   | CHEMBL465682 |
ZINC   |
Molecular Weight:   | 218.17 |
ALogP:   | 2.6819 |
MLogP:   | 3 |
XLogP:   | 4.071 |
# Rotatable Bonds:   | 3 |
Polar Surface Area:   | 17.07 |
# H-Bond Aceptor:   | 1 |
# H-Bond Donor:   | 0 |
# Rings:   | 2 |
# Heavy Atoms:   | 16 |