Natural Product: NPC251681

Natural Product ID:  NPC251681
Common Name:   Uvaretin
IUPAC Name:   1-[2,4-dihydroxy-3-[(2-hydroxyphenyl)methyl]-6-methoxyphenyl]-3-phenylpropan-1-one
Synonyms:   Uvaretin
Molecular Formula:   C23H22O5
Standard InCHIKey:  LQHGGFQNRNEFIG-UHFFFAOYSA-N
Standard InCHI:  InChI=1S/C23H22O5/c1-28-21-14-20(26)17(13-16-9-5-6-10-18(16)24)23(27)22(21)19(25)12-11-15-7-3-2-4-8-15/h2-10,14,24,26-27H,11-13H2,1H3
Canonical SMILES:  COc1cc(O)c(c(c1C(=O)CCc1ccccc1)O)Cc1ccccc1O
First Find Year:  
Max Developmental Stage:  
Synthetic Gene Cluster:   ;

  Species Source

Organism ID Organism Name Taxonomy Level Family SuperKingdom Isolation Part Collection Location Collection Time Reference
NPO8708 Vibrio cholerae Species Vibrionaceae Bacteria UNPD*
NPO10814 Ilex latifolia Species Aquifoliaceae Eukaryota TCMID*
NPO14915 Uvaria acuminata Species Annonaceae Eukaryota TCMID*
NPO16941 Uvaria angolensis Species Annonaceae Eukaryota TCMID*
NPO18174 Rinodina lepida Species Physciaceae Eukaryota UNPD*
NPO19209 Trichodesma zeylanicum Species Boraginaceae Eukaryota UNPD*
NPO17816 Parmelia latissima Species Parmeliaceae Eukaryota UNPD*
NPO17722 Athroisma gracile Species Asteraceae Eukaryota UNPD*
NPO22878 Libocedrus bidwillii Species Cupressaceae Eukaryota UNPD*
NPO16941 Uvaria angolensis Species Annonaceae Eukaryota TCM_Taiwan*
NPO20502 Swertia cincta Species Gentianaceae Eukaryota UNPD*
NPO12116 Anabasis brevifolia Species Chenopodiaceae Eukaryota UNPD*
NPO25162 Astragalus eupeplus Species Fabaceae Eukaryota UNPD*
NPO15901 Pentanema indicum Species Asteraceae Eukaryota UNPD*
NPO23099 Astragalus microcephalus Species Fabaceae Eukaryota UNPD*
NPO19790 Cyclamen africanum Species Primulaceae Eukaryota UNPD*
NPO7058 Australostichopus mollis Species Stichopodidae Eukaryota UNPD*
NPO20363 Senecio morrisonensis Species Asteraceae Eukaryota UNPD*

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT485 Organism Plasmodium falciparum (isolate K1 / Thailand) Plasmodium falciparum K1 EC50 = 3.49 ug/ml 9748386
NPT368 Cell Line SN12C Homo sapiens GI50 4819.48 nM PubChem BioAssay data set
NPT370 Cell Line NCI-H23 Homo sapiens GI50 4168.69 nM PubChem BioAssay data set
NPT371 Cell Line UO-31 Homo sapiens GI50 6208.69 nM PubChem BioAssay data set
NPT116 Cell Line HL-60 Homo sapiens GI50 4425.88 nM PubChem BioAssay data set
NPT372 Cell Line HOP-92 Homo sapiens GI50 3990.25 nM PubChem BioAssay data set
NPT374 Cell Line SF-539 Homo sapiens GI50 5407.54 nM PubChem BioAssay data set
NPT375 Cell Line Malme-3M Homo sapiens GI50 4886.52 nM PubChem BioAssay data set
NPT373 Cell Line SK-MEL-5 Homo sapiens GI50 3689.78 nM PubChem BioAssay data set
NPT376 Cell Line A498 Homo sapiens GI50 1479.11 nM PubChem BioAssay data set
NPT111 Cell Line K562 Homo sapiens GI50 5260.17 nM PubChem BioAssay data set
NPT377 Cell Line OVCAR-3 Homo sapiens GI50 4581.42 nM PubChem BioAssay data set
NPT112 Cell Line MOLT-4 Homo sapiens GI50 3854.78 nM PubChem BioAssay data set
NPT379 Cell Line HOP-62 Homo sapiens GI50 2466.04 nM PubChem BioAssay data set
NPT380 Cell Line U-251 Homo sapiens GI50 5116.82 nM PubChem BioAssay data set
NPT378 Cell Line NCI/ADR-RES Homo sapiens GI50 5662.39 nM PubChem BioAssay data set
NPT382 Cell Line OVCAR-5 Homo sapiens GI50 4602.57 nM PubChem BioAssay data set
NPT381 Cell Line OVCAR-8 Homo sapiens GI50 6412.1 nM PubChem BioAssay data set
NPT383 Cell Line SNB-19 Homo sapiens GI50 6546.36 nM PubChem BioAssay data set
NPT572 Cell Line DMS-273 Homo sapiens GI50 4385.31 nM PubChem BioAssay data set
NPT323 Cell Line SW-620 Homo sapiens GI50 7227.7 nM PubChem BioAssay data set
NPT573 Cell Line M19-MEL Homo sapiens GI50 6067.36 nM PubChem BioAssay data set
NPT455 Cell Line NCI-H522 Homo sapiens GI50 2296.15 nM PubChem BioAssay data set
NPT574 Cell Line XF498 Homo sapiens GI50 3213.66 nM PubChem BioAssay data set
NPT386 Cell Line KM12 Homo sapiens GI50 6807.69 nM PubChem BioAssay data set
NPT389 Cell Line RPMI-8226 Homo sapiens GI50 2437.81 nM PubChem BioAssay data set
NPT388 Cell Line NCI-H322M Homo sapiens GI50 6918.31 nM PubChem BioAssay data set
NPT456 Cell Line OVCAR-4 Homo sapiens GI50 6546.36 nM PubChem BioAssay data set
NPT168 Cell Line P388 Mus musculus GI50 4365.16 nM PubChem BioAssay data set
NPT390 Cell Line LOX IMVI Homo sapiens GI50 6053.41 nM PubChem BioAssay data set
NPT147 Cell Line SK-MEL-2 Homo sapiens GI50 4709.77 nM PubChem BioAssay data set
NPT81 Cell Line A549 Homo sapiens GI50 5915.62 nM PubChem BioAssay data set
NPT575 Cell Line KM-20L2 Homo sapiens GI50 7345.14 nM PubChem BioAssay data set
NPT391 Cell Line HCC 2998 Homo sapiens GI50 6095.37 nM PubChem BioAssay data set
NPT392 Cell Line SNB-75 Homo sapiens GI50 6918.31 nM PubChem BioAssay data set
NPT148 Cell Line HCT-15 Homo sapiens GI50 5714.79 nM PubChem BioAssay data set
NPT395 Cell Line SF-268 Homo sapiens GI50 7014.55 nM PubChem BioAssay data set
NPT393 Cell Line HCT-116 Homo sapiens GI50 4305.27 nM PubChem BioAssay data set
NPT394 Cell Line EKVX Homo sapiens GI50 6194.41 nM PubChem BioAssay data set
NPT83 Cell Line MCF7 Homo sapiens GI50 5807.64 nM PubChem BioAssay data set
NPT576 Cell Line DMS-114 Homo sapiens GI50 4092.61 nM PubChem BioAssay data set
NPT146 Cell Line SK-OV-3 Homo sapiens GI50 6151.77 nM PubChem BioAssay data set
NPT397 Cell Line NCI-H460 Homo sapiens GI50 4487.45 nM PubChem BioAssay data set
NPT398 Cell Line UACC-62 Homo sapiens GI50 4395.42 nM PubChem BioAssay data set
NPT552 Cell Line P388/ADR Mus musculus GI50 5382.7 nM PubChem BioAssay data set
NPT308 Cell Line CAKI-1 Homo sapiens GI50 5236 nM PubChem BioAssay data set
NPT399 Cell Line SF-295 Homo sapiens GI50 5902.01 nM PubChem BioAssay data set
NPT458 Cell Line IGROV-1 Homo sapiens GI50 6966.27 nM PubChem BioAssay data set
NPT403 Cell Line UACC-257 Homo sapiens GI50 5357.97 nM PubChem BioAssay data set
NPT578 Cell Line SNB-78 Homo sapiens GI50 7638.36 nM PubChem BioAssay data set
NPT404 Cell Line CCRF-CEM Homo sapiens GI50 6208.69 nM PubChem BioAssay data set
NPT579 Cell Line DLD-1 Homo sapiens GI50 7328.25 nM PubChem BioAssay data set
NPT405 Cell Line NCI-H226 Homo sapiens GI50 6622.17 nM PubChem BioAssay data set
NPT170 Cell Line SK-MEL-28 Homo sapiens GI50 6998.42 nM PubChem BioAssay data set
NPT139 Cell Line HT-29 Homo sapiens GI50 11857.69 nM PubChem BioAssay data set
NPT406 Cell Line RXF 393 Homo sapiens GI50 6067.36 nM PubChem BioAssay data set
NPT407 Cell Line COLO 205 Homo sapiens GI50 5915.62 nM PubChem BioAssay data set
NPT738 Cell Line SN12K1 Homo sapiens GI50 5546.26 nM PubChem BioAssay data set
NPT732 Cell Line HOP-18 Homo sapiens GI50 712.85 nM PubChem BioAssay data set

  Similar Natural Products in NPASS

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 NPC251681 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 NPC243528
0.9778 High Similarity NPC26238
0.9773 High Similarity NPC13575
0.9699 High Similarity NPC186838
0.9699 High Similarity NPC1486
0.9699 High Similarity NPC66349
0.9699 High Similarity NPC12165
0.9699 High Similarity NPC41461
0.9699 High Similarity NPC25287
0.9699 High Similarity NPC477244
0.9699 High Similarity NPC274109
0.9699 High Similarity NPC249606
0.9699 High Similarity NPC168105
0.9699 High Similarity NPC477242
0.9699 High Similarity NPC150399
0.9699 High Similarity NPC477243
0.9699 High Similarity NPC98115
0.9697 High Similarity NPC103842
0.9627 High Similarity NPC317119
0.9627 High Similarity NPC472419
0.9627 High Similarity NPC153979
0.9624 High Similarity NPC156092
0.9624 High Similarity NPC131039
0.9621 High Similarity NPC204960
0.9621 High Similarity NPC294593
0.9621 High Similarity NPC159623
0.9621 High Similarity NPC20560
0.9621 High Similarity NPC144051
0.9621 High Similarity NPC18877
0.9621 High Similarity NPC28753
0.9621 High Similarity NPC82225
0.9565 High Similarity NPC282957
0.9565 High Similarity NPC194949
0.9559 High Similarity NPC215311
0.9559 High Similarity NPC204985
0.9559 High Similarity NPC172250
0.9559 High Similarity NPC159275
0.9559 High Similarity NPC259166
0.9559 High Similarity NPC219917
0.9559 High Similarity NPC241100
0.9559 High Similarity NPC213659
0.9559 High Similarity NPC48624
0.9559 High Similarity NPC144118
0.9559 High Similarity NPC80962
0.9559 High Similarity NPC326109
0.9556 High Similarity NPC21350
0.9549 High Similarity NPC286336
0.9496 High Similarity NPC470131
0.9496 High Similarity NPC470132
0.9496 High Similarity NPC473078
0.9496 High Similarity NPC109183
0.9496 High Similarity NPC25844
0.9496 High Similarity NPC470134
0.9496 High Similarity NPC470133
0.9489 High Similarity NPC268204
0.9489 High Similarity NPC469404
0.9489 High Similarity NPC52789
0.9489 High Similarity NPC282300
0.9489 High Similarity NPC26051
0.9489 High Similarity NPC14871
0.9489 High Similarity NPC110969
0.9489 High Similarity NPC55832
0.9485 High Similarity NPC55018
0.9485 High Similarity NPC283429
0.9485 High Similarity NPC96565
0.9485 High Similarity NPC216978
0.9485 High Similarity NPC472366
0.9485 High Similarity NPC301217
0.9485 High Similarity NPC303633
0.9485 High Similarity NPC53181
0.9485 High Similarity NPC217186
0.9485 High Similarity NPC470211
0.9485 High Similarity NPC18260
0.9485 High Similarity NPC295384
0.9485 High Similarity NPC220062
0.9485 High Similarity NPC78913
0.9485 High Similarity NPC477956
0.9474 High Similarity NPC472365
0.9474 High Similarity NPC188646
0.9474 High Similarity NPC139813
0.9474 High Similarity NPC242294
0.9474 High Similarity NPC192304
0.9474 High Similarity NPC337373
0.9474 High Similarity NPC27643
0.9474 High Similarity NPC312318
0.9474 High Similarity NPC175098
0.9474 High Similarity NPC263670
0.9474 High Similarity NPC56031
0.947 High Similarity NPC186097
0.947 High Similarity NPC475009
0.947 High Similarity NPC475008
0.9429 High Similarity NPC475348
0.9429 High Similarity NPC261271
0.9424 High Similarity NPC39045
0.9424 High Similarity NPC470135
0.9424 High Similarity NPC470136
0.942 High Similarity NPC148757
0.942 High Similarity NPC324436
0.942 High Similarity NPC167624
0.942 High Similarity NPC328164
0.942 High Similarity NPC182852
0.942 High Similarity NPC226636
0.942 High Similarity NPC37496
0.942 High Similarity NPC296917
0.942 High Similarity NPC177354
0.942 High Similarity NPC40833
0.942 High Similarity NPC66515
0.942 High Similarity NPC1089
0.942 High Similarity NPC223500
0.942 High Similarity NPC166934
0.942 High Similarity NPC306829
0.942 High Similarity NPC227579
0.942 High Similarity NPC194432
0.942 High Similarity NPC265040
0.942 High Similarity NPC76372
0.942 High Similarity NPC166482
0.942 High Similarity NPC10937
0.942 High Similarity NPC32739
0.942 High Similarity NPC107572
0.942 High Similarity NPC220998
0.942 High Similarity NPC78
0.942 High Similarity NPC297600
0.942 High Similarity NPC64915
0.942 High Similarity NPC161506
0.942 High Similarity NPC228504
0.942 High Similarity NPC76338
0.942 High Similarity NPC11561
0.942 High Similarity NPC324134
0.942 High Similarity NPC125855
0.9416 High Similarity NPC270883
0.9416 High Similarity NPC253822
0.9416 High Similarity NPC172986
0.9416 High Similarity NPC265178
0.9416 High Similarity NPC261227
0.9416 High Similarity NPC101366
0.9416 High Similarity NPC11056
0.9416 High Similarity NPC69769
0.9416 High Similarity NPC150522
0.9412 High Similarity NPC471620
0.9412 High Similarity NPC201395
0.9398 High Similarity NPC205468
0.9398 High Similarity NPC87231
0.9398 High Similarity NPC15834
0.9398 High Similarity NPC129132
0.9398 High Similarity NPC215875
0.9398 High Similarity NPC212631
0.9398 High Similarity NPC257756
0.9362 High Similarity NPC152233
0.9357 High Similarity NPC228779
0.9353 High Similarity NPC169591
0.9353 High Similarity NPC39329
0.9353 High Similarity NPC310130
0.9353 High Similarity NPC478086
0.9353 High Similarity NPC150408
0.9353 High Similarity NPC106985
0.9353 High Similarity NPC475705
0.9353 High Similarity NPC68104
0.9353 High Similarity NPC278249
0.9353 High Similarity NPC476178
0.9353 High Similarity NPC81697
0.9353 High Similarity NPC166138
0.9353 High Similarity NPC149026
0.9353 High Similarity NPC257097
0.9353 High Similarity NPC214166
0.9353 High Similarity NPC185276
0.9353 High Similarity NPC316816
0.9353 High Similarity NPC107177
0.9353 High Similarity NPC51887
0.9353 High Similarity NPC18585
0.9353 High Similarity NPC91560
0.9353 High Similarity NPC85162
0.9353 High Similarity NPC143896
0.9353 High Similarity NPC75049
0.9353 High Similarity NPC117836
0.9353 High Similarity NPC221432
0.9353 High Similarity NPC125894
0.9353 High Similarity NPC223812
0.9353 High Similarity NPC164980
0.9353 High Similarity NPC175504
0.9353 High Similarity NPC77794
0.9348 High Similarity NPC40118
0.9348 High Similarity NPC232021
0.9348 High Similarity NPC110038
0.9348 High Similarity NPC321980
0.9348 High Similarity NPC3188
0.9348 High Similarity NPC166689
0.9348 High Similarity NPC64908
0.9348 High Similarity NPC324386
0.9348 High Similarity NPC96408
0.9348 High Similarity NPC248372
0.9348 High Similarity NPC103362
0.9348 High Similarity NPC4743
0.9348 High Similarity NPC156190
0.9348 High Similarity NPC156590
0.9348 High Similarity NPC147688
0.9348 High Similarity NPC258630
0.9348 High Similarity NPC17170
0.9348 High Similarity NPC213322
0.9348 High Similarity NPC205006
0.9348 High Similarity NPC118840

  Similar Clinical/Approved Drugs

Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.

●  The left chart: Distribution of similarity level between NPC251681 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
0.9323 High Similarity NPD1240 Approved
0.9286 High Similarity NPD4378 Clinical (unspecified phase)
0.9286 High Similarity NPD7410 Clinical (unspecified phase)
0.9191 High Similarity NPD1510 Phase 2
0.9185 High Similarity NPD1607 Approved
0.9058 High Similarity NPD1552 Clinical (unspecified phase)
0.9058 High Similarity NPD1550 Clinical (unspecified phase)
0.9034 High Similarity NPD7411 Suspended
0.8993 High Similarity NPD1549 Phase 2
0.898 High Similarity NPD8443 Clinical (unspecified phase)
0.8836 High Similarity NPD4380 Phase 2
0.8784 High Similarity NPD2393 Clinical (unspecified phase)
0.8714 High Similarity NPD2796 Approved
0.8662 High Similarity NPD7421 Clinical (unspecified phase)
0.8633 High Similarity NPD6651 Approved
0.8609 High Similarity NPD7075 Discontinued
0.8543 High Similarity NPD7768 Phase 2
0.8533 High Similarity NPD7819 Suspended
0.8533 High Similarity NPD7096 Clinical (unspecified phase)
0.8516 High Similarity NPD7852 Clinical (unspecified phase)
0.8506 High Similarity NPD6232 Discontinued
0.8467 Intermediate Similarity NPD6801 Discontinued
0.8467 Intermediate Similarity NPD1934 Approved
0.8462 Intermediate Similarity NPD7473 Discontinued
0.8451 Intermediate Similarity NPD2935 Discontinued
0.8442 Intermediate Similarity NPD6959 Discontinued
0.8425 Intermediate Similarity NPD1511 Approved
0.8425 Intermediate Similarity NPD6799 Approved
0.8411 Intermediate Similarity NPD2801 Approved
0.8333 Intermediate Similarity NPD970 Clinical (unspecified phase)
0.8311 Intermediate Similarity NPD1512 Approved
0.828 Intermediate Similarity NPD6167 Clinical (unspecified phase)
0.828 Intermediate Similarity NPD6166 Phase 2
0.828 Intermediate Similarity NPD6168 Clinical (unspecified phase)
0.8276 Intermediate Similarity NPD2800 Approved
0.8252 Intermediate Similarity NPD1509 Clinical (unspecified phase)
0.8247 Intermediate Similarity NPD3749 Approved
0.8247 Intermediate Similarity NPD4381 Clinical (unspecified phase)
0.8219 Intermediate Similarity NPD3750 Approved
0.8214 Intermediate Similarity NPD6859 Clinical (unspecified phase)
0.8212 Intermediate Similarity NPD6599 Discontinued
0.8182 Intermediate Similarity NPD3882 Suspended
0.8176 Intermediate Similarity NPD7390 Discontinued
0.8125 Intermediate Similarity NPD7804 Clinical (unspecified phase)
0.8121 Intermediate Similarity NPD2533 Approved
0.8121 Intermediate Similarity NPD2532 Approved
0.8121 Intermediate Similarity NPD2534 Approved
0.8095 Intermediate Similarity NPD1878 Clinical (unspecified phase)
0.8085 Intermediate Similarity NPD4907 Clinical (unspecified phase)
0.8069 Intermediate Similarity NPD1551 Phase 2
0.8027 Intermediate Similarity NPD1243 Approved
0.8014 Intermediate Similarity NPD2344 Approved
0.8 Intermediate Similarity NPD2799 Discontinued
0.8 Intermediate Similarity NPD3817 Phase 2
0.7972 Intermediate Similarity NPD943 Approved
0.7949 Intermediate Similarity NPD4868 Clinical (unspecified phase)
0.7943 Intermediate Similarity NPD4908 Phase 1
0.7929 Intermediate Similarity NPD2798 Approved
0.7927 Intermediate Similarity NPD4419 Clinical (unspecified phase)
0.7914 Intermediate Similarity NPD5953 Discontinued
0.7911 Intermediate Similarity NPD5494 Approved
0.7905 Intermediate Similarity NPD2654 Approved
0.7901 Intermediate Similarity NPD7286 Phase 2
0.7895 Intermediate Similarity NPD5403 Approved
0.7895 Intermediate Similarity NPD6980 Clinical (unspecified phase)
0.7895 Intermediate Similarity NPD920 Approved
0.7877 Intermediate Similarity NPD3748 Approved
0.7867 Intermediate Similarity NPD643 Clinical (unspecified phase)
0.7866 Intermediate Similarity NPD6559 Discontinued
0.7857 Intermediate Similarity NPD1203 Approved
0.7853 Intermediate Similarity NPD7074 Phase 3
0.784 Intermediate Similarity NPD3818 Discontinued
0.7832 Intermediate Similarity NPD2313 Discontinued
0.78 Intermediate Similarity NPD2309 Approved
0.7792 Intermediate Similarity NPD3226 Approved
0.7791 Intermediate Similarity NPD7054 Approved
0.7791 Intermediate Similarity NPD5844 Phase 1
0.777 Intermediate Similarity NPD3972 Approved
0.7763 Intermediate Similarity NPD642 Clinical (unspecified phase)
0.7763 Intermediate Similarity NPD5401 Approved
0.7744 Intermediate Similarity NPD7472 Approved
0.7733 Intermediate Similarity NPD7003 Approved
0.7708 Intermediate Similarity NPD3268 Approved
0.7703 Intermediate Similarity NPD6099 Approved
0.7703 Intermediate Similarity NPD6100 Approved
0.7703 Intermediate Similarity NPD5406 Approved
0.7703 Intermediate Similarity NPD5404 Approved
0.7703 Intermediate Similarity NPD5405 Approved
0.7703 Intermediate Similarity NPD5408 Approved
0.7698 Intermediate Similarity NPD1547 Clinical (unspecified phase)
0.7698 Intermediate Similarity NPD1201 Approved
0.7697 Intermediate Similarity NPD6797 Phase 2
0.7692 Intermediate Similarity NPD6832 Phase 2
0.7677 Intermediate Similarity NPD7458 Discontinued
0.7664 Intermediate Similarity NPD1548 Phase 1
0.7651 Intermediate Similarity NPD7251 Discontinued
0.7647 Intermediate Similarity NPD9493 Approved
0.7643 Intermediate Similarity NPD9717 Approved
0.7635 Intermediate Similarity NPD7033 Discontinued
0.7616 Intermediate Similarity NPD4628 Phase 3
0.7606 Intermediate Similarity NPD2797 Approved
0.7606 Intermediate Similarity NPD1470 Approved
0.7605 Intermediate Similarity NPD7808 Phase 3
0.7586 Intermediate Similarity NPD3764 Approved
0.7586 Intermediate Similarity NPD8090 Clinical (unspecified phase)
0.7582 Intermediate Similarity NPD6143 Clinical (unspecified phase)
0.7571 Intermediate Similarity NPD1610 Phase 2
0.7571 Intermediate Similarity NPD422 Phase 1
0.7547 Intermediate Similarity NPD5402 Approved
0.7546 Intermediate Similarity NPD3926 Phase 2
0.7536 Intermediate Similarity NPD9545 Approved
0.7533 Intermediate Similarity NPD2346 Discontinued
0.7516 Intermediate Similarity NPD919 Approved
0.75 Intermediate Similarity NPD4338 Clinical (unspecified phase)
0.75 Intermediate Similarity NPD6398 Clinical (unspecified phase)
0.7485 Intermediate Similarity NPD5710 Approved
0.7485 Intermediate Similarity NPD7993 Clinical (unspecified phase)
0.7485 Intermediate Similarity NPD5711 Approved
0.7483 Intermediate Similarity NPD1164 Approved
0.7471 Intermediate Similarity NPD4363 Phase 3
0.7471 Intermediate Similarity NPD4360 Phase 2
0.7468 Intermediate Similarity NPD7615 Clinical (unspecified phase)
0.7466 Intermediate Similarity NPD6798 Discontinued
0.7432 Intermediate Similarity NPD5124 Phase 1
0.7432 Intermediate Similarity NPD5123 Clinical (unspecified phase)
0.7429 Intermediate Similarity NPD4361 Phase 2
0.7429 Intermediate Similarity NPD4362 Clinical (unspecified phase)
0.7425 Intermediate Similarity NPD1729 Discontinued
0.7423 Intermediate Similarity NPD1247 Approved
0.7419 Intermediate Similarity NPD7004 Clinical (unspecified phase)
0.7413 Intermediate Similarity NPD3225 Approved
0.74 Intermediate Similarity NPD4308 Phase 3
0.7397 Intermediate Similarity NPD4625 Phase 3
0.7378 Intermediate Similarity NPD7229 Phase 3
0.7361 Intermediate Similarity NPD3266 Approved
0.7361 Intermediate Similarity NPD3267 Approved
0.7357 Intermediate Similarity NPD4196 Clinical (unspecified phase)
0.7356 Intermediate Similarity NPD7879 Clinical (unspecified phase)
0.7342 Intermediate Similarity NPD5808 Clinical (unspecified phase)
0.7315 Intermediate Similarity NPD230 Phase 1
0.7315 Intermediate Similarity NPD1933 Approved
0.7292 Intermediate Similarity NPD1876 Approved
0.7285 Intermediate Similarity NPD651 Clinical (unspecified phase)
0.7279 Intermediate Similarity NPD3027 Phase 3
0.7273 Intermediate Similarity NPD1608 Approved
0.7267 Intermediate Similarity NPD1465 Phase 2
0.7241 Intermediate Similarity NPD8397 Clinical (unspecified phase)
0.7241 Intermediate Similarity NPD4287 Approved
0.7234 Intermediate Similarity NPD1651 Approved
0.723 Intermediate Similarity NPD1296 Phase 2
0.7222 Intermediate Similarity NPD2296 Approved
0.7222 Intermediate Similarity NPD4288 Approved
0.7212 Intermediate Similarity NPD7199 Phase 2
0.7211 Intermediate Similarity NPD1529 Clinical (unspecified phase)
0.7205 Intermediate Similarity NPD37 Approved
0.72 Intermediate Similarity NPD1899 Clinical (unspecified phase)
0.7197 Intermediate Similarity NPD7422 Clinical (unspecified phase)
0.719 Intermediate Similarity NPD2343 Clinical (unspecified phase)
0.7181 Intermediate Similarity NPD6233 Phase 2
0.7174 Intermediate Similarity NPD1241 Discontinued
0.7172 Intermediate Similarity NPD1283 Approved
0.7167 Intermediate Similarity NPD7501 Clinical (unspecified phase)
0.7151 Intermediate Similarity NPD8312 Approved
0.7151 Intermediate Similarity NPD8313 Approved
0.7143 Intermediate Similarity NPD1530 Clinical (unspecified phase)
0.7143 Intermediate Similarity NPD5889 Approved
0.7143 Intermediate Similarity NPD5890 Approved
0.7135 Intermediate Similarity NPD6104 Discontinued
0.7134 Intermediate Similarity NPD6971 Discontinued
0.7134 Intermediate Similarity NPD7213 Phase 3
0.7134 Intermediate Similarity NPD7212 Phase 2
0.7133 Intermediate Similarity NPD1613 Approved
0.7133 Intermediate Similarity NPD3847 Discontinued
0.7133 Intermediate Similarity NPD4307 Phase 2
0.7133 Intermediate Similarity NPD1612 Clinical (unspecified phase)
0.7126 Intermediate Similarity NPD7184 Clinical (unspecified phase)
0.7121 Intermediate Similarity NPD940 Approved
0.7121 Intermediate Similarity NPD846 Approved
0.7114 Intermediate Similarity NPD411 Approved
0.7103 Intermediate Similarity NPD4379 Clinical (unspecified phase)
0.7103 Intermediate Similarity NPD4749 Approved
0.7103 Intermediate Similarity NPD3600 Clinical (unspecified phase)
0.7101 Intermediate Similarity NPD7893 Clinical (unspecified phase)
0.7101 Intermediate Similarity NPD7177 Discontinued
0.7099 Intermediate Similarity NPD7577 Discontinued
0.7091 Intermediate Similarity NPD6234 Discontinued
0.7089 Intermediate Similarity NPD7447 Phase 1
0.7086 Intermediate Similarity NPD447 Suspended
0.7081 Intermediate Similarity NPD6585 Discontinued
0.7081 Intermediate Similarity NPD6502 Phase 2
0.7078 Intermediate Similarity NPD1471 Phase 3
0.7075 Intermediate Similarity NPD1019 Discontinued
0.7073 Intermediate Similarity NPD4967 Phase 2
0.7073 Intermediate Similarity NPD4965 Approved
0.7073 Intermediate Similarity NPD4966 Approved
0.7072 Intermediate Similarity NPD6782 Approved
0.7072 Intermediate Similarity NPD6779 Approved
0.7072 Intermediate Similarity NPD6778 Approved
0.7072 Intermediate Similarity NPD6781 Approved
0.7072 Intermediate Similarity NPD6777 Approved

Structure

External Identifiers

PubChem CID   73447
ChEMBL   CHEMBL523296
ZINC  

Physicochemical Properties

Molecular Weight:  378.15
ALogP:  -1.1431
MLogP:  3.44
XLogP:  5.656
# Rotatable Bonds:  11
Polar Surface Area:  86.99
# H-Bond Aceptor:  1
# H-Bond Donor:  3
# Rings:  3
# Heavy Atoms:  28

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General Info & Identifiers & Properties  
Structure MOL file  
Source Organisms  
Biological Activities  
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