Natural Product: NPC224921

Natural Product ID:  NPC224921
Common Name:   n.a.
IUPAC Name:  
Synonyms:   (-)-Hopeaphenol
Molecular Formula:   C56H42O12
Standard InCHIKey:  YQQUILZPDYJDQJ-KGDQSQJYSA-N
Standard InCHI:  InChI=1S/C56H42O12/c57-29-9-1-25(2-10-29)45-47-37(17-33(61)21-41(47)65)53-49-39(19-35(63)23-43(49)67-55(53)27-5-13-31(59)14-6-27)51(45)52-40-20-36(64)24-44-50(40)54(56(68-44)28-7-15-32(60)16-8-28)38-18-34(62)22-42(66)48(38)46(52)26-3-11-30(58)12-4-26/h1-24,45-46,51-66H/t45-,46-,51-,52-,53-,54-,55+,56+/m1/s1
Canonical SMILES:  Oc1ccc(cc1)[C@H]1[C@H]([C@H]2[C@H](c3ccc(cc3)O)c3c(O)cc(cc3[C@@H]3c4c2cc(O)cc4O[C@H]3c2ccc(cc2)O)O)c2cc(O)cc3c2[C@@H](c2c1c(O)cc(c2)O)[C@@H](O3)c1ccc(cc1)O
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
NPO17472 Drechslera avenae Species Pleosporaceae Eukaryota UNPD*
NPO17024 Vitis vinifera Species Vitaceae Eukaryota UNPD*
NPO10313 Plantago arborescens Species Plantaginaceae Eukaryota UNPD*
NPO9516 Gnetum latifolium Species Gnetaceae Eukaryota UNPD*
NPO10417 Ipomoea digitata Species Convolvulaceae Eukaryota UNPD*
NPO15063 Leathesia nana Species Chordariaceae Eukaryota UNPD*
NPO16369 Lepisorus ussuriensis Species Polypodiaceae Eukaryota UNPD*
NPO17242 Laurencia spectabilis Species Rhodomelaceae Eukaryota UNPD*
NPO14547 Ilex pubescens Species Aquifoliaceae Eukaryota UNPD*
NPO947 Rauvolfia vomitoria Species Apocynaceae Eukaryota UNPD*
NPO21724 Sabina sargentii NA NA NA UNPD*
NPO17865 Amathia pinnata Species Vesiculariidae Eukaryota UNPD*
NPO11917 Asterospicularia laurae Species Xeniidae Eukaryota UNPD*
NPO9711 Leccinum aurantiacum Species Boletaceae Eukaryota UNPD*
NPO12703 Eucalyptus melliodora Species Myrtaceae Eukaryota UNPD*
NPO7562 Premna odorata Species Lamiaceae Eukaryota UNPD*
NPO6028 Laurencia pinnatifida Species Rhodomelaceae Eukaryota UNPD*
NPO11941 Helleborus serbicus Species Ranunculaceae Eukaryota UNPD*
NPO17702 Astragalus sempervirens Species Fabaceae Eukaryota UNPD*
NPO17094 Sinularia depressa Species Alcyoniidae Eukaryota UNPD*
NPO2507 Rumex maritimus Species Polygonaceae Eukaryota UNPD*
NPO17169 Adiantum lunulatum Species Pteridaceae Eukaryota UNPD*
NPO14859 Bishovia boliviensis NA NA NA UNPD*
NPO16596 Dysoxylum schiffneri Species Meliaceae Eukaryota UNPD*
NPO12049 Lecania gerlachei Species Ramalinaceae Eukaryota UNPD*
NPO15659 Zanthoxylum tetraspermum Species Rutaceae Eukaryota UNPD*
NPO16731 Phoebe pittieri Species Lauraceae Eukaryota UNPD*
NPO8506 Cotyledon secunda Species Crassulaceae Eukaryota UNPD*
NPO13407 Goniothalamus malayanus Species Annonaceae Eukaryota UNPD*
NPO4980 Lycopodium erythraeum Species Lycopodiaceae Eukaryota UNPD*
NPO26327 Chaenomeles sinensis Species Rosaceae Eukaryota UNPD*
NPO6160 Vaccinium oxycoccos Species Ericaceae Eukaryota UNPD*
NPO16347 Viguiera greggii Species Asteraceae Eukaryota UNPD*
NPO13642 Pastinaca sativa Species Apiaceae Eukaryota UNPD*
NPO15134 Alnus glutinosa Species Betulaceae Eukaryota UNPD*
NPO4181 Pseudoalteromonas luteoviolacea Species Pseudoalteromonadaceae Bacteria UNPD*
NPO5899 Ainsliaea uniflora Species Asteraceae Eukaryota UNPD*
NPO17942 Wikstroemia retusa Species Thymelaeaceae Eukaryota UNPD*
NPO13167 Scutellaria amoena Species Lamiaceae Eukaryota UNPD*
NPO15552 Anacystis montana NA NA NA UNPD*
NPO17400 Peltostigma guatemalense Species Rutaceae Eukaryota UNPD*
NPO16493 Nasutitermes ephratae Species Termitoidae Eukaryota UNPD*
NPO11304 Vitis thunbergii Species Vitaceae Eukaryota UNPD*
NPO10989 Annona cornifolia Species Annonaceae Eukaryota UNPD*
NPO11641 Solanum laxum Species Solanaceae Eukaryota UNPD*
NPO17544 Acacia adunca Species Fabaceae Eukaryota UNPD*
NPO5239 Hyrtios erectus Species Thorectidae Eukaryota UNPD*
NPO913 Pelophylax plancyi Species Ranidae Eukaryota UNPD*
NPO15803 Artemisia assoana Species Asteraceae Eukaryota UNPD*
NPO14395 Lysimachia mauritiana Species Primulaceae Eukaryota UNPD*
NPO13847 Streptomyces avermitilis Species Streptomycetaceae Bacteria UNPD*
NPO10086 Scrophularia scorodonia Species Scrophulariaceae Eukaryota UNPD*
NPO8519 Garcinia andamanica Species Clusiaceae Eukaryota UNPD*
NPO14028 Guizotia abyssinica Species Asteraceae Eukaryota UNPD*
NPO6881 Caragana aurantiaca Species Fabaceae Eukaryota UNPD*
NPO12673 Phyllanthus acidus Species Phyllanthaceae Eukaryota UNPD*
NPO16857 Hypericum laricifolium Species Hypericaceae Eukaryota UNPD*
NPO222 Phebalium drummondii Species Rutaceae Eukaryota UNPD*
NPO15227 Helipterum roseum Species Asteraceae Eukaryota UNPD*
NPO16089 Dumortiera hirsuta Species Dumortieraceae Eukaryota UNPD*
NPO17633 Viguiera incana Species Asteraceae Eukaryota UNPD*
NPO15467 Hedysarum connatum Species Fabaceae Eukaryota UNPD*
NPO17786 Marrubium anisodon Species Lamiaceae Eukaryota UNPD*
NPO9038 Aconitum burnatii Species Ranunculaceae Eukaryota UNPD*
NPO13369 Morinda longiflora Species Rubiaceae Eukaryota UNPD*
NPO1276 Thonningia sanguinea Species Balanophoraceae Eukaryota UNPD*
NPO7794 Vatica albiramis Species Dipterocarpaceae Eukaryota PMID[20735051]
NPO3964 Calostephane divaricata Species Asteraceae Eukaryota UNPD*
NPO14685 Swertia franchetiana Species Gentianaceae Eukaryota UNPD*
NPO26194 Shorea roxburghii Species Dipterocarpaceae Eukaryota Barks PMID[22209731]
NPO11728 Shorea hemsleyana Species Dipterocarpaceae Eukaryota UNPD*
NPO20597 Phascolion strombus Species Phascolionidae Eukaryota UNPD*
NPO32500 anisoptera sp. Species NA NA Papua New Guinean rainforest PMID[25405587]
NPO18022 Naucleopsis ternstroemiiflora Species Moraceae Eukaryota UNPD*
NPO11538 Salvia syriaca Species Lamiaceae Eukaryota UNPD*
NPO4325 Blastochloris viridis Species Hyphomicrobiaceae Bacteria UNPD*
NPO16611 Alstonia spathulata Species Apocynaceae Eukaryota UNPD*

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT91 Cell Line KB Homo sapiens ED50 = 1.2 ug/ml 10571175
NPT81 Cell Line A549 Homo sapiens ED50 = 4.8 ug/ml 10571175
NPT83 Cell Line MCF7 Homo sapiens ED50 = 4.2 ug/ml 10571175
NPT309 Cell Line 1A9 Homo sapiens ED50 = 7.8 ug/ml 10571175
NPT2405 Cell Line SAOS-2 Homo sapiens ED50 > 20 ug/ml 10571175
NPT2405 Cell Line SAOS-2 Homo sapiens Inhibition = 41 % 10571175
NPT32 Organism Mus musculus Mus musculus Inhibition = 191.6 % 22209731
NPT32 Organism Mus musculus Mus musculus Inhibition = 194.9 % 22209731
NPT32 Organism Mus musculus Mus musculus Inhibition = 160.6 % 22209731
NPT32 Organism Mus musculus Mus musculus Inhibition = 158.3 % 22209731
NPT32 Organism Mus musculus Mus musculus Inhibition = 187.9 % 22209731
NPT32 Organism Mus musculus Mus musculus Inhibition = 179.4 % 22209731
NPT32 Organism Mus musculus Mus musculus Activity = 58.2 % 22209731
NPT32 Organism Mus musculus Mus musculus Inhibition = 29 % 22209731
NPT1765 Tissue Intestine Rattus norvegicus Inhibition = 21.8 % 22209731
NPT671 Individual Protein Acidic alpha-glucosidase Rattus norvegicus IC50 = 338000 nM 22209731
NPT462 Individual Protein Sucrase-isomaltase Rattus norvegicus IC50 = 195000 nM 22209731
NPT68 Individual Protein Aldose reductase Rattus norvegicus IC50 = 69000 nM 22209731
NPT2 Others Unspecified IC50 = 8800 nM 25405587
NPT2 Others Unspecified IC50 = 2900 nM 25405587

  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 NPC224921 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 NPC237546
1.0 High Similarity NPC231712
1.0 High Similarity NPC242774
0.9716 High Similarity NPC111134
0.9574 High Similarity NPC149633
0.9448 High Similarity NPC105073
0.9448 High Similarity NPC224528
0.9448 High Similarity NPC233886
0.9444 High Similarity NPC122980
0.9444 High Similarity NPC177172
0.9444 High Similarity NPC148516
0.9444 High Similarity NPC107862
0.9444 High Similarity NPC180605
0.9441 High Similarity NPC6702
0.9441 High Similarity NPC133209
0.9441 High Similarity NPC112819
0.9371 High Similarity NPC176804
0.9371 High Similarity NPC71686
0.9247 High Similarity NPC218801
0.9236 High Similarity NPC14468
0.922 High Similarity NPC213607
0.922 High Similarity NPC182509
0.922 High Similarity NPC174787
0.9209 High Similarity NPC15109
0.9209 High Similarity NPC11727
0.9184 High Similarity NPC157081
0.9145 High Similarity NPC48880
0.9 High Similarity NPC157333
0.8993 High Similarity NPC473018
0.8993 High Similarity NPC120633
0.894 High Similarity NPC202104
0.8936 High Similarity NPC125579
0.8873 High Similarity NPC141717
0.8836 High Similarity NPC15659
0.8836 High Similarity NPC304894
0.8811 High Similarity NPC470308
0.8811 High Similarity NPC470307
0.8786 High Similarity NPC473309
0.8767 High Similarity NPC173203
0.8767 High Similarity NPC163508
0.8742 High Similarity NPC476391
0.8742 High Similarity NPC233467
0.8741 High Similarity NPC471522
0.8732 High Similarity NPC476616
0.8732 High Similarity NPC476615
0.8732 High Similarity NPC476617
0.8725 High Similarity NPC329836
0.8675 High Similarity NPC324517
0.8675 High Similarity NPC321972
0.8675 High Similarity NPC329343
0.8643 High Similarity NPC471518
0.8643 High Similarity NPC471519
0.8562 High Similarity NPC273623
0.8543 High Similarity NPC473266
0.8543 High Similarity NPC470098
0.8543 High Similarity NPC470826
0.8535 High Similarity NPC90822
0.8533 High Similarity NPC328567
0.8533 High Similarity NPC327412
0.8533 High Similarity NPC320671
0.8533 High Similarity NPC320970
0.8531 High Similarity NPC469610
0.8521 High Similarity NPC471517
0.8521 High Similarity NPC8899
0.8497 Intermediate Similarity NPC59692
0.8481 Intermediate Similarity NPC261896
0.8477 Intermediate Similarity NPC227516
0.8477 Intermediate Similarity NPC20757
0.8472 Intermediate Similarity NPC473107
0.8467 Intermediate Similarity NPC317053
0.8467 Intermediate Similarity NPC324492
0.8462 Intermediate Similarity NPC469611
0.8451 Intermediate Similarity NPC254000
0.8425 Intermediate Similarity NPC71465
0.8425 Intermediate Similarity NPC472646
0.8421 Intermediate Similarity NPC476969
0.8421 Intermediate Similarity NPC321657
0.8421 Intermediate Similarity NPC318373
0.8414 Intermediate Similarity NPC258780
0.8414 Intermediate Similarity NPC37410
0.8403 Intermediate Similarity NPC473665
0.8392 Intermediate Similarity NPC237424
0.8392 Intermediate Similarity NPC238168
0.8378 Intermediate Similarity NPC100482
0.8378 Intermediate Similarity NPC277331
0.8377 Intermediate Similarity NPC279406
0.8377 Intermediate Similarity NPC226809
0.8366 Intermediate Similarity NPC477612
0.8357 Intermediate Similarity NPC113495
0.8356 Intermediate Similarity NPC206525
0.8356 Intermediate Similarity NPC191462
0.8356 Intermediate Similarity NPC472648
0.8356 Intermediate Similarity NPC170328
0.8356 Intermediate Similarity NPC133463
0.8356 Intermediate Similarity NPC472649
0.8356 Intermediate Similarity NPC472647
0.8333 Intermediate Similarity NPC475492
0.8333 Intermediate Similarity NPC114119
0.8333 Intermediate Similarity NPC470097
0.8333 Intermediate Similarity NPC471415
0.8323 Intermediate Similarity NPC224161
0.8311 Intermediate Similarity NPC472090
0.8311 Intermediate Similarity NPC472092
0.8311 Intermediate Similarity NPC472091
0.831 Intermediate Similarity NPC47283
0.831 Intermediate Similarity NPC39064
0.8298 Intermediate Similarity NPC471215
0.8298 Intermediate Similarity NPC262573
0.8289 Intermediate Similarity NPC170103
0.8289 Intermediate Similarity NPC153182
0.8289 Intermediate Similarity NPC82917
0.8289 Intermediate Similarity NPC174251
0.8289 Intermediate Similarity NPC108811
0.8289 Intermediate Similarity NPC202742
0.8289 Intermediate Similarity NPC18185
0.8289 Intermediate Similarity NPC70409
0.8289 Intermediate Similarity NPC204770
0.8289 Intermediate Similarity NPC262911
0.8289 Intermediate Similarity NPC294558
0.8289 Intermediate Similarity NPC263940
0.8289 Intermediate Similarity NPC236202
0.8289 Intermediate Similarity NPC58190
0.828 Intermediate Similarity NPC55463
0.828 Intermediate Similarity NPC166116
0.8278 Intermediate Similarity NPC181615
0.8269 Intermediate Similarity NPC46335
0.8264 Intermediate Similarity NPC129784
0.8264 Intermediate Similarity NPC181497
0.8264 Intermediate Similarity NPC280653
0.8264 Intermediate Similarity NPC236014
0.8264 Intermediate Similarity NPC150011
0.8264 Intermediate Similarity NPC300875
0.8264 Intermediate Similarity NPC282508
0.8264 Intermediate Similarity NPC17343
0.8264 Intermediate Similarity NPC207892
0.8264 Intermediate Similarity NPC118114
0.8264 Intermediate Similarity NPC271945
0.8264 Intermediate Similarity NPC472590
0.8264 Intermediate Similarity NPC196765
0.8264 Intermediate Similarity NPC12875
0.8264 Intermediate Similarity NPC228369
0.8264 Intermediate Similarity NPC129106
0.8264 Intermediate Similarity NPC476166
0.8264 Intermediate Similarity NPC268917
0.8264 Intermediate Similarity NPC206224
0.8264 Intermediate Similarity NPC164574
0.8255 Intermediate Similarity NPC178054
0.8235 Intermediate Similarity NPC281549
0.8224 Intermediate Similarity NPC274454
0.8224 Intermediate Similarity NPC260397
0.8224 Intermediate Similarity NPC96576
0.8224 Intermediate Similarity NPC215678
0.8219 Intermediate Similarity NPC296915
0.8219 Intermediate Similarity NPC115335
0.8219 Intermediate Similarity NPC198154
0.8219 Intermediate Similarity NPC225696
0.8219 Intermediate Similarity NPC223008
0.8219 Intermediate Similarity NPC97834
0.8212 Intermediate Similarity NPC171932
0.8212 Intermediate Similarity NPC28440
0.8207 Intermediate Similarity NPC13005
0.82 Intermediate Similarity NPC472088
0.82 Intermediate Similarity NPC472087
0.8194 Intermediate Similarity NPC471403
0.8194 Intermediate Similarity NPC470225
0.8194 Intermediate Similarity NPC27187
0.8188 Intermediate Similarity NPC262189
0.8188 Intermediate Similarity NPC22317
0.8182 Intermediate Similarity NPC211561
0.8182 Intermediate Similarity NPC295573
0.8182 Intermediate Similarity NPC470208
0.8176 Intermediate Similarity NPC474687
0.817 Intermediate Similarity NPC262297
0.8169 Intermediate Similarity NPC283049
0.8169 Intermediate Similarity NPC50315
0.8169 Intermediate Similarity NPC230479
0.8169 Intermediate Similarity NPC26879
0.8138 Intermediate Similarity NPC162801
0.8133 Intermediate Similarity NPC470372
0.8133 Intermediate Similarity NPC472089
0.8129 Intermediate Similarity NPC205501
0.8129 Intermediate Similarity NPC162976
0.8129 Intermediate Similarity NPC118000
0.8125 Intermediate Similarity NPC93962
0.8125 Intermediate Similarity NPC1253
0.8125 Intermediate Similarity NPC100936
0.8121 Intermediate Similarity NPC260842
0.8121 Intermediate Similarity NPC55947
0.8113 Intermediate Similarity NPC4809
0.8113 Intermediate Similarity NPC125495
0.8113 Intermediate Similarity NPC73517
0.8113 Intermediate Similarity NPC470827
0.8113 Intermediate Similarity NPC147743
0.8108 Intermediate Similarity NPC3049
0.8108 Intermediate Similarity NPC234952
0.8105 Intermediate Similarity NPC102280
0.8105 Intermediate Similarity NPC248053
0.8105 Intermediate Similarity NPC155564
0.8095 Intermediate Similarity NPC256307
0.8095 Intermediate Similarity NPC66840

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC224921 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
0.844 Intermediate Similarity NPD4908 Phase 1
0.8322 Intermediate Similarity NPD4907 Clinical (unspecified phase)
0.8071 Intermediate Similarity NPD1610 Phase 2
0.7862 Intermediate Similarity NPD2861 Phase 2
0.7786 Intermediate Similarity NPD1548 Phase 1
0.7755 Intermediate Similarity NPD4625 Phase 3
0.7718 Intermediate Similarity NPD1612 Clinical (unspecified phase)
0.7718 Intermediate Similarity NPD1613 Approved
0.7586 Intermediate Similarity NPD4749 Approved
0.7584 Intermediate Similarity NPD6410 Clinical (unspecified phase)
0.7568 Intermediate Similarity NPD1529 Clinical (unspecified phase)
0.7546 Intermediate Similarity NPD8443 Clinical (unspecified phase)
0.7532 Intermediate Similarity NPD7447 Phase 1
0.753 Intermediate Similarity NPD6959 Discontinued
0.75 Intermediate Similarity NPD1530 Clinical (unspecified phase)
0.7468 Intermediate Similarity NPD7213 Phase 3
0.7468 Intermediate Similarity NPD7212 Phase 2
0.7425 Intermediate Similarity NPD7199 Phase 2
0.7412 Intermediate Similarity NPD7228 Approved
0.741 Intermediate Similarity NPD6234 Discontinued
0.74 Intermediate Similarity NPD3027 Phase 3
0.7394 Intermediate Similarity NPD7768 Phase 2
0.7394 Intermediate Similarity NPD4966 Approved
0.7394 Intermediate Similarity NPD4965 Approved
0.7394 Intermediate Similarity NPD4967 Phase 2
0.7389 Intermediate Similarity NPD7466 Approved
0.7389 Intermediate Similarity NPD3892 Phase 2
0.7372 Intermediate Similarity NPD7037 Approved
0.7337 Intermediate Similarity NPD7184 Clinical (unspecified phase)
0.732 Intermediate Similarity NPD5735 Approved
0.7315 Intermediate Similarity NPD6917 Clinical (unspecified phase)
0.7312 Intermediate Similarity NPD7004 Clinical (unspecified phase)
0.7278 Intermediate Similarity NPD7229 Phase 3
0.7278 Intermediate Similarity NPD3750 Approved
0.7273 Intermediate Similarity NPD7819 Suspended
0.7255 Intermediate Similarity NPD4060 Phase 1
0.7244 Intermediate Similarity NPD6099 Approved
0.7244 Intermediate Similarity NPD6100 Approved
0.7237 Intermediate Similarity NPD6859 Clinical (unspecified phase)
0.723 Intermediate Similarity NPD5327 Phase 3
0.723 Intermediate Similarity NPD3600 Clinical (unspecified phase)
0.7215 Intermediate Similarity NPD5698 Clinical (unspecified phase)
0.7212 Intermediate Similarity NPD37 Approved
0.7193 Intermediate Similarity NPD7852 Clinical (unspecified phase)
0.7186 Intermediate Similarity NPD4868 Clinical (unspecified phase)
0.7184 Intermediate Similarity NPD7993 Clinical (unspecified phase)
0.7169 Intermediate Similarity NPD8455 Phase 2
0.7161 Intermediate Similarity NPD6353 Approved
0.7143 Intermediate Similarity NPD3749 Approved
0.7143 Intermediate Similarity NPD7040 Clinical (unspecified phase)
0.7143 Intermediate Similarity NPD7041 Phase 2
0.7119 Intermediate Similarity NPD8054 Approved
0.7119 Intermediate Similarity NPD8053 Approved
0.7097 Intermediate Similarity NPD5124 Phase 1
0.7097 Intermediate Similarity NPD5123 Clinical (unspecified phase)
0.7093 Intermediate Similarity NPD6168 Clinical (unspecified phase)
0.7093 Intermediate Similarity NPD6167 Clinical (unspecified phase)
0.7093 Intermediate Similarity NPD6166 Phase 2
0.7089 Intermediate Similarity NPD1552 Clinical (unspecified phase)
0.7089 Intermediate Similarity NPD1550 Clinical (unspecified phase)
0.7086 Intermediate Similarity NPD6584 Phase 3
0.7067 Intermediate Similarity NPD6696 Suspended
0.7062 Intermediate Similarity NPD8313 Approved
0.7062 Intermediate Similarity NPD8312 Approved
0.7045 Intermediate Similarity NPD7240 Approved
0.7044 Intermediate Similarity NPD1549 Phase 2
0.7032 Intermediate Similarity NPD4140 Approved
0.7 Intermediate Similarity NPD6674 Discontinued
0.6994 Remote Similarity NPD7410 Clinical (unspecified phase)
0.6981 Remote Similarity NPD5762 Approved
0.6981 Remote Similarity NPD5763 Approved
0.698 Remote Similarity NPD422 Phase 1
0.6971 Remote Similarity NPD5844 Phase 1
0.6971 Remote Similarity NPD8156 Discontinued
0.6966 Remote Similarity NPD6671 Approved
0.6964 Remote Similarity NPD2393 Clinical (unspecified phase)
0.6962 Remote Similarity NPD3748 Approved
0.6957 Remote Similarity NPD6398 Clinical (unspecified phase)
0.6954 Remote Similarity NPD8651 Approved
0.6946 Remote Similarity NPD7411 Suspended
0.6943 Remote Similarity NPD4097 Suspended
0.6928 Remote Similarity NPD8158 Clinical (unspecified phase)
0.6928 Remote Similarity NPD5808 Clinical (unspecified phase)
0.6928 Remote Similarity NPD3018 Phase 2
0.6914 Remote Similarity NPD8099 Discontinued
0.6914 Remote Similarity NPD8251 Approved
0.6914 Remote Similarity NPD8252 Approved
0.691 Remote Similarity NPD8453 Clinical (unspecified phase)
0.6905 Remote Similarity NPD1934 Approved
0.6903 Remote Similarity NPD6812 Clinical (unspecified phase)
0.6899 Remote Similarity NPD7119 Phase 2
0.6899 Remote Similarity NPD7097 Phase 1
0.689 Remote Similarity NPD7446 Clinical (unspecified phase)
0.689 Remote Similarity NPD4378 Clinical (unspecified phase)
0.6887 Remote Similarity NPD6582 Phase 2
0.6887 Remote Similarity NPD6583 Phase 3
0.6886 Remote Similarity NPD4380 Phase 2
0.6879 Remote Similarity NPD3787 Discontinued
0.6879 Remote Similarity NPD6355 Discontinued
0.6875 Remote Similarity NPD7843 Approved
0.6857 Remote Similarity NPD7473 Discontinued
0.6855 Remote Similarity NPD1510 Phase 2
0.6849 Remote Similarity NPD7157 Approved
0.6845 Remote Similarity NPD7615 Clinical (unspecified phase)
0.6842 Remote Similarity NPD7075 Discontinued
0.6842 Remote Similarity NPD4381 Clinical (unspecified phase)
0.6836 Remote Similarity NPD7074 Phase 3
0.6835 Remote Similarity NPD2157 Approved
0.6832 Remote Similarity NPD970 Clinical (unspecified phase)
0.6829 Remote Similarity NPD7390 Discontinued
0.6818 Remote Similarity NPD3818 Discontinued
0.6815 Remote Similarity NPD2238 Phase 2
0.6815 Remote Similarity NPD3620 Phase 2
0.6815 Remote Similarity NPD3619 Clinical (unspecified phase)
0.6813 Remote Similarity NPD2796 Approved
0.6796 Remote Similarity NPD8055 Clinical (unspecified phase)
0.6795 Remote Similarity NPD6798 Discontinued
0.6789 Remote Similarity NPD7680 Approved
0.6788 Remote Similarity NPD4160 Clinical (unspecified phase)
0.6784 Remote Similarity NPD3882 Suspended
0.6783 Remote Similarity NPD4750 Phase 3
0.6782 Remote Similarity NPD6232 Discontinued
0.678 Remote Similarity NPD7804 Clinical (unspecified phase)
0.678 Remote Similarity NPD7054 Approved
0.6776 Remote Similarity NPD2983 Phase 2
0.6776 Remote Similarity NPD2982 Phase 2
0.6766 Remote Similarity NPD1653 Approved
0.6763 Remote Similarity NPD5494 Approved
0.676 Remote Similarity NPD6559 Discontinued
0.6755 Remote Similarity NPD1091 Approved
0.6753 Remote Similarity NPD4624 Approved
0.675 Remote Similarity NPD5588 Approved
0.675 Remote Similarity NPD7033 Discontinued
0.6748 Remote Similarity NPD7003 Approved
0.6747 Remote Similarity NPD6273 Approved
0.6742 Remote Similarity NPD7472 Approved
0.6733 Remote Similarity NPD5846 Approved
0.6733 Remote Similarity NPD6516 Phase 2
0.6731 Remote Similarity NPD7095 Approved
0.6727 Remote Similarity NPD1511 Approved
0.6724 Remote Similarity NPD8127 Discontinued
0.6722 Remote Similarity NPD7549 Discontinued
0.6722 Remote Similarity NPD7808 Phase 3
0.6721 Remote Similarity NPD7906 Approved
0.6712 Remote Similarity NPD5283 Phase 1
0.6711 Remote Similarity NPD1840 Phase 2
0.6711 Remote Similarity NPD2981 Phase 2
0.6711 Remote Similarity NPD7741 Discontinued
0.6711 Remote Similarity NPD3091 Approved
0.671 Remote Similarity NPD1712 Approved
0.6691 Remote Similarity NPD1242 Phase 1
0.669 Remote Similarity NPD968 Approved
0.6688 Remote Similarity NPD3094 Phase 2
0.6688 Remote Similarity NPD2797 Approved
0.6688 Remote Similarity NPD3764 Approved
0.6687 Remote Similarity NPD7020 Approved
0.6687 Remote Similarity NPD2532 Approved
0.6687 Remote Similarity NPD7421 Clinical (unspecified phase)
0.6687 Remote Similarity NPD2534 Approved
0.6687 Remote Similarity NPD2533 Approved
0.6687 Remote Similarity NPD7019 Approved
0.6685 Remote Similarity NPD8397 Clinical (unspecified phase)
0.6667 Remote Similarity NPD2029 Clinical (unspecified phase)
0.6667 Remote Similarity NPD7046 Clinical (unspecified phase)
0.6667 Remote Similarity NPD6005 Phase 3
0.6667 Remote Similarity NPD6006 Clinical (unspecified phase)
0.6667 Remote Similarity NPD3444 Approved
0.6667 Remote Similarity NPD7237 Clinical (unspecified phase)
0.6667 Remote Similarity NPD6002 Phase 3
0.6667 Remote Similarity NPD2801 Approved
0.6667 Remote Similarity NPD6004 Phase 3
0.6667 Remote Similarity NPD7096 Clinical (unspecified phase)
0.6667 Remote Similarity NPD3443 Approved
0.6667 Remote Similarity NPD6003 Clinical (unspecified phase)
0.6667 Remote Similarity NPD7251 Discontinued
0.6667 Remote Similarity NPD3445 Approved
0.6667 Remote Similarity NPD1465 Phase 2
0.6648 Remote Similarity NPD7090 Clinical (unspecified phase)
0.6648 Remote Similarity NPD8051 Clinical (unspecified phase)
0.6647 Remote Similarity NPD7833 Phase 2
0.6647 Remote Similarity NPD1512 Approved
0.6647 Remote Similarity NPD7975 Clinical (unspecified phase)
0.6647 Remote Similarity NPD7831 Phase 2
0.6647 Remote Similarity NPD7832 Clinical (unspecified phase)
0.6646 Remote Similarity NPD8032 Phase 2
0.6645 Remote Similarity NPD3705 Approved
0.6645 Remote Similarity NPD3092 Approved
0.6644 Remote Similarity NPD5535 Approved
0.6643 Remote Similarity NPD940 Approved
0.6643 Remote Similarity NPD846 Approved
0.6629 Remote Similarity NPD3751 Discontinued
0.6629 Remote Similarity NPD7493 Clinical (unspecified phase)
0.6628 Remote Similarity NPD6374 Clinical (unspecified phase)
0.6628 Remote Similarity NPD2563 Approved
0.6628 Remote Similarity NPD2560 Approved
0.6628 Remote Similarity NPD5402 Approved
0.6627 Remote Similarity NPD6055 Clinical (unspecified phase)
0.6627 Remote Similarity NPD6143 Clinical (unspecified phase)
0.6623 Remote Similarity NPD3225 Approved
0.6623 Remote Similarity NPD4626 Approved

Structure

External Identifiers

PubChem CID   44334030
ChEMBL   CHEMBL384120
ZINC  

Physicochemical Properties

Molecular Weight:  906.27
ALogP:  -5.5386
MLogP:  6.3
XLogP:  8.118
# Rotatable Bonds:  15
Polar Surface Area:  220.76
# H-Bond Aceptor:  0
# H-Bond Donor:  10
# Rings:  12
# Heavy Atoms:  68

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Structure MOL file  
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Biological Activities  
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