Natural Product: NPC289346

Natural Product ID:  NPC289346
Common Name:   (E)-Resveratrol 3-(6' '-Galloyl)-O-Beta-D-Glucopyranoside
IUPAC Name:   [(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[3-hydroxy-5-[(E)-2-(4-hydroxyphenyl)ethenyl]phenoxy]oxan-2-yl]methyl 3,4,5-trihydroxybenzoate
Synonyms:  
Molecular Formula:   C27H26O12
Standard InCHIKey:  YGKDMUYXJBMRBO-XMPPFBFMSA-N
Standard InCHI:  InChI=1S/C27H26O12/c28-16-5-3-13(4-6-16)1-2-14-7-17(29)11-18(8-14)38-27-25(35)24(34)23(33)21(39-27)12-37-26(36)15-9-19(30)22(32)20(31)10-15/h1-11,21,23-25,27-35H,12H2/b2-1+/t21-,23-,24+,25-,27-/m1/s1
Canonical SMILES:  Oc1cc(cc(c1)/C=C/c1ccc(cc1)O)O[C@@H]1O[C@H](COC(=O)c2cc(O)c(c(c2)O)O)[C@H]([C@@H]([C@H]1O)O)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
NPO1501 Senecio subdentatus Species Asteraceae Eukaryota UNPD*
NPO11749 Eria mollis Species Orchidaceae Eukaryota UNPD*
NPO13237 Teucrium yemense Species Lamiaceae Eukaryota UNPD*
NPO21918 Aconitum heterophylloides Species Ranunculaceae Eukaryota UNPD*
NPO10688 Flacourtia jangomas Species Salicaceae Eukaryota UNPD*
NPO2631 Aster sedifolius Species Asteraceae Eukaryota UNPD*
NPO21164 Veratrum dahuricum Species Melanthiaceae Eukaryota UNPD*
NPO3214 Lavandula vera Species Lamiaceae Eukaryota UNPD*
NPO9448 Dictyopteris australis Species Dictyotaceae Eukaryota UNPD*
NPO4345 Caulocystis cephalornithos Species Sargassaceae Eukaryota UNPD*
NPO32936 calligonum leucocladum Species Polygonaceae Eukaryota PMID[15217293]
NPO9752 Miliusa velutina Species Annonaceae Eukaryota UNPD*
NPO14304 Physalis alkekengi Species Solanaceae Eukaryota UNPD*
NPO21036 Celaenodendron mexicanum Species NA NA UNPD*
NPO11580 Onobrychis arenaria Species Fabaceae Eukaryota UNPD*
NPO20715 Astragalus cibarius Species Fabaceae Eukaryota UNPD*
NPO11391 Polygonum cuspidatum Species Polygonaceae Eukaryota UNPD*
NPO986 Rattus rattus Species Muridae Eukaryota UNPD*
NPO8386 Enceliopsis argophylla Species Asteraceae Eukaryota UNPD*
NPO12252 Psychotria stachyoides Species Rubiaceae Eukaryota UNPD*
NPO2198 Rivularia firma Species Rivulariaceae Bacteria UNPD*
NPO21542 Vernonia menthaefolia Species Asteraceae Eukaryota UNPD*
NPO12079 Dysoxylum cumingianum Species Meliaceae Eukaryota UNPD*
NPO7819.1 Epichloe festucae var. lolii Varieties Clavicipitaceae Eukaryota UNPD*
NPO14104 Dendriopoterium menendezii Species Rosaceae Eukaryota UNPD*
NPO22526 Justicia secunda Species Acanthaceae Eukaryota UNPD*
NPO17130 Hylotelephium telephium Species Crassulaceae Eukaryota UNPD*
NPO12477 Dodonaea viscosa Species Sapindaceae Eukaryota UNPD*
NPO14217 Adansonia grandidieri Species Malvaceae Eukaryota UNPD*
NPO14412 Aphyllocladus denticulatus Species Asteraceae Eukaryota UNPD*
NPO18859 Carica pennata Species Caricaceae Eukaryota UNPD*
NPO13523 Neobalanocarpus heimii Species Dipterocarpaceae Eukaryota UNPD*
NPO13716 Aconitum tasiromontanum Species Ranunculaceae Eukaryota UNPD*
NPO13403 Gadus morhua callarias Species Gadidae Eukaryota UNPD*
NPO624 Isaria fumosorosea Species Cordycipitaceae Eukaryota UNPD*
NPO14014 Eriocheir sinensis Species Varunidae Eukaryota UNPD*
NPO13421 Sphaerella laricina NA NA NA UNPD*
NPO16590 Cytophaga hutchinsoni Species Cytophagaceae Bacteria UNPD*
NPO19969 Dermocybe canaria Species Cortinariaceae Eukaryota UNPD*
NPO15297 Aconitum seravschanicum Species Ranunculaceae Eukaryota UNPD*
NPO14520 Bassia muricata Species Chenopodiaceae Eukaryota UNPD*

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT2 Others Unspecified Ratio = 1.3 15217293
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 125 ug/ml 15217293
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC > 250 ug/ml 15217293
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 250 ug/ml 15217293

  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 NPC289346 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
0.9869 High Similarity NPC33298
0.9869 High Similarity NPC285108
0.9869 High Similarity NPC90905
0.9869 High Similarity NPC4013
0.9673 High Similarity NPC160780
0.9673 High Similarity NPC289811
0.9673 High Similarity NPC74319
0.9673 High Similarity NPC287872
0.961 High Similarity NPC239966
0.961 High Similarity NPC203020
0.9608 High Similarity NPC1913
0.9608 High Similarity NPC133984
0.9557 High Similarity NPC198125
0.9557 High Similarity NPC95421
0.9557 High Similarity NPC658
0.9557 High Similarity NPC197708
0.9548 High Similarity NPC311803
0.9548 High Similarity NPC472859
0.9548 High Similarity NPC25389
0.9497 High Similarity NPC149011
0.9497 High Similarity NPC204937
0.9484 High Similarity NPC119125
0.9484 High Similarity NPC166277
0.9481 High Similarity NPC472860
0.9474 High Similarity NPC44260
0.9474 High Similarity NPC205037
0.9474 High Similarity NPC16024
0.9474 High Similarity NPC3746
0.9474 High Similarity NPC61152
0.9437 High Similarity NPC102851
0.9437 High Similarity NPC5786
0.9427 High Similarity NPC121290
0.9412 High Similarity NPC191046
0.9412 High Similarity NPC327032
0.9412 High Similarity NPC194095
0.9379 High Similarity NPC172033
0.9379 High Similarity NPC175230
0.9379 High Similarity NPC88560
0.9359 High Similarity NPC24164
0.9355 High Similarity NPC289322
0.9355 High Similarity NPC68324
0.9355 High Similarity NPC160512
0.9355 High Similarity NPC38779
0.9355 High Similarity NPC156818
0.9355 High Similarity NPC114179
0.9346 High Similarity NPC310661
0.9346 High Similarity NPC105827
0.9342 High Similarity NPC140151
0.9338 High Similarity NPC92117
0.9317 High Similarity NPC47140
0.9317 High Similarity NPC67134
0.9313 High Similarity NPC149300
0.929 High Similarity NPC471405
0.929 High Similarity NPC250436
0.929 High Similarity NPC291948
0.929 High Similarity NPC300845
0.929 High Similarity NPC104983
0.929 High Similarity NPC88803
0.9281 High Similarity NPC36130
0.9281 High Similarity NPC134905
0.9272 High Similarity NPC248257
0.9272 High Similarity NPC120621
0.9264 High Similarity NPC144097
0.9264 High Similarity NPC472991
0.9264 High Similarity NPC61904
0.9264 High Similarity NPC79736
0.9264 High Similarity NPC67629
0.9264 High Similarity NPC472992
0.9259 High Similarity NPC472993
0.925 High Similarity NPC116745
0.925 High Similarity NPC473818
0.9241 High Similarity NPC148273
0.9236 High Similarity NPC53889
0.9231 High Similarity NPC238419
0.9231 High Similarity NPC172419
0.9226 High Similarity NPC10205
0.9221 High Similarity NPC157898
0.9207 High Similarity NPC476618
0.9207 High Similarity NPC476623
0.9207 High Similarity NPC476619
0.9207 High Similarity NPC37668
0.9207 High Similarity NPC476622
0.9207 High Similarity NPC253521
0.9207 High Similarity NPC476620
0.9207 High Similarity NPC476621
0.9207 High Similarity NPC113836
0.9207 High Similarity NPC267549
0.9207 High Similarity NPC35167
0.9202 High Similarity NPC34267
0.9202 High Similarity NPC223426
0.9202 High Similarity NPC81042
0.9202 High Similarity NPC214621
0.9182 High Similarity NPC88043
0.9182 High Similarity NPC168822
0.9172 High Similarity NPC87317
0.9167 High Similarity NPC239019
0.9167 High Similarity NPC247629
0.9167 High Similarity NPC318432
0.9156 High Similarity NPC75695
0.9146 High Similarity NPC297574
0.9146 High Similarity NPC154741
0.9146 High Similarity NPC296018
0.9145 High Similarity NPC142528
0.9141 High Similarity NPC163165
0.9136 High Similarity NPC155763
0.9136 High Similarity NPC20505
0.9136 High Similarity NPC235260
0.913 High Similarity NPC45400
0.9125 High Similarity NPC165720
0.9119 High Similarity NPC41009
0.9119 High Similarity NPC77660
0.9119 High Similarity NPC189142
0.9114 High Similarity NPC476373
0.9097 High Similarity NPC137813
0.9097 High Similarity NPC474656
0.9096 High Similarity NPC53680
0.9096 High Similarity NPC208797
0.9091 High Similarity NPC476773
0.9091 High Similarity NPC267680
0.9091 High Similarity NPC196127
0.9091 High Similarity NPC472387
0.9091 High Similarity NPC293626
0.9091 High Similarity NPC217387
0.9091 High Similarity NPC258044
0.9091 High Similarity NPC217520
0.9091 High Similarity NPC139571
0.9085 High Similarity NPC169645
0.9085 High Similarity NPC111785
0.9085 High Similarity NPC84482
0.908 High Similarity NPC211594
0.908 High Similarity NPC254540
0.908 High Similarity NPC190003
0.908 High Similarity NPC175107
0.908 High Similarity NPC172807
0.9074 High Similarity NPC138927
0.9074 High Similarity NPC229687
0.9073 High Similarity NPC108455
0.9062 High Similarity NPC191306
0.9062 High Similarity NPC19709
0.9062 High Similarity NPC270335
0.9062 High Similarity NPC29830
0.9051 High Similarity NPC210501
0.9051 High Similarity NPC114791
0.9051 High Similarity NPC141331
0.9051 High Similarity NPC318826
0.9051 High Similarity NPC104222
0.9042 High Similarity NPC36138
0.9042 High Similarity NPC97119
0.9042 High Similarity NPC135831
0.9042 High Similarity NPC297503
0.9036 High Similarity NPC80956
0.9036 High Similarity NPC471030
0.9026 High Similarity NPC473091
0.9024 High Similarity NPC4390
0.9018 High Similarity NPC116864
0.9018 High Similarity NPC471416
0.9018 High Similarity NPC34287
0.9018 High Similarity NPC244776
0.9012 High Similarity NPC229729
0.9012 High Similarity NPC146792
0.9012 High Similarity NPC58716
0.9012 High Similarity NPC45618
0.9007 High Similarity NPC121573
0.9007 High Similarity NPC190587
0.9007 High Similarity NPC22176
0.9007 High Similarity NPC229036
0.9007 High Similarity NPC226738
0.9006 High Similarity NPC142614
0.9006 High Similarity NPC311830
0.9006 High Similarity NPC277205
0.9006 High Similarity NPC22832
0.9 High Similarity NPC127782
0.9 High Similarity NPC476371
0.9 High Similarity NPC300537
0.9 High Similarity NPC291957
0.9 High Similarity NPC473043
0.9 High Similarity NPC14030
0.9 High Similarity NPC476372
0.8988 High Similarity NPC470416
0.8988 High Similarity NPC231254
0.8987 High Similarity NPC226759
0.8982 High Similarity NPC8940
0.8982 High Similarity NPC469371
0.8981 High Similarity NPC145425
0.8976 High Similarity NPC477895
0.897 High Similarity NPC135277
0.897 High Similarity NPC115760
0.897 High Similarity NPC210094
0.897 High Similarity NPC237435
0.897 High Similarity NPC477848
0.897 High Similarity NPC43211
0.897 High Similarity NPC101191
0.897 High Similarity NPC253685
0.897 High Similarity NPC49344
0.8968 High Similarity NPC93619
0.8963 High Similarity NPC307518
0.8963 High Similarity NPC153755
0.8963 High Similarity NPC472386
0.8963 High Similarity NPC205076
0.8963 High Similarity NPC48773

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC289346 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
0.929 High Similarity NPD4868 Clinical (unspecified phase)
0.897 High Similarity NPD4338 Clinical (unspecified phase)
0.8896 High Similarity NPD3818 Discontinued
0.8841 High Similarity NPD7054 Approved
0.8788 High Similarity NPD7472 Approved
0.8788 High Similarity NPD7074 Phase 3
0.875 High Similarity NPD4381 Clinical (unspecified phase)
0.8735 High Similarity NPD6797 Phase 2
0.8735 High Similarity NPD7993 Clinical (unspecified phase)
0.8683 High Similarity NPD7251 Discontinued
0.8545 High Similarity NPD6166 Phase 2
0.8545 High Similarity NPD6168 Clinical (unspecified phase)
0.8545 High Similarity NPD6167 Clinical (unspecified phase)
0.8521 High Similarity NPD7808 Phase 3
0.8481 Intermediate Similarity NPD1653 Approved
0.8462 Intermediate Similarity NPD7685 Pre-registration
0.8418 Intermediate Similarity NPD6980 Clinical (unspecified phase)
0.8393 Intermediate Similarity NPD5844 Phase 1
0.8385 Intermediate Similarity NPD1934 Approved
0.8333 Intermediate Similarity NPD2393 Clinical (unspecified phase)
0.8333 Intermediate Similarity NPD1465 Phase 2
0.8333 Intermediate Similarity NPD6190 Approved
0.8246 Intermediate Similarity NPD6559 Discontinued
0.8225 Intermediate Similarity NPD7228 Approved
0.8224 Intermediate Similarity NPD230 Phase 1
0.8221 Intermediate Similarity NPD2801 Approved
0.8194 Intermediate Similarity NPD7266 Discontinued
0.8176 Intermediate Similarity NPD7804 Clinical (unspecified phase)
0.8171 Intermediate Similarity NPD3817 Phase 2
0.8148 Intermediate Similarity NPD4380 Phase 2
0.8144 Intermediate Similarity NPD7199 Phase 2
0.8133 Intermediate Similarity NPD6234 Discontinued
0.8121 Intermediate Similarity NPD3882 Suspended
0.8113 Intermediate Similarity NPD6143 Clinical (unspecified phase)
0.8113 Intermediate Similarity NPD1511 Approved
0.8072 Intermediate Similarity NPD7075 Discontinued
0.8061 Intermediate Similarity NPD5402 Approved
0.8049 Intermediate Similarity NPD37 Approved
0.8012 Intermediate Similarity NPD4965 Approved
0.8012 Intermediate Similarity NPD1512 Approved
0.8012 Intermediate Similarity NPD4966 Approved
0.8012 Intermediate Similarity NPD4967 Phase 2
0.7988 Intermediate Similarity NPD6232 Discontinued
0.7988 Intermediate Similarity NPD7411 Suspended
0.7955 Intermediate Similarity NPD8055 Clinical (unspecified phase)
0.7943 Intermediate Similarity NPD8313 Approved
0.7943 Intermediate Similarity NPD8312 Approved
0.7941 Intermediate Similarity NPD7184 Clinical (unspecified phase)
0.7925 Intermediate Similarity NPD4628 Phase 3
0.7892 Intermediate Similarity NPD7096 Clinical (unspecified phase)
0.7892 Intermediate Similarity NPD8455 Phase 2
0.7853 Intermediate Similarity NPD5403 Approved
0.7849 Intermediate Similarity NPD7473 Discontinued
0.7833 Intermediate Similarity NPD7879 Clinical (unspecified phase)
0.7831 Intermediate Similarity NPD6801 Discontinued
0.7806 Intermediate Similarity NPD1612 Clinical (unspecified phase)
0.7806 Intermediate Similarity NPD1613 Approved
0.7803 Intermediate Similarity NPD3751 Discontinued
0.7799 Intermediate Similarity NPD1549 Phase 2
0.7784 Intermediate Similarity NPD7819 Suspended
0.7778 Intermediate Similarity NPD6799 Approved
0.7765 Intermediate Similarity NPD5494 Approved
0.7738 Intermediate Similarity NPD8443 Clinical (unspecified phase)
0.7736 Intermediate Similarity NPD1552 Clinical (unspecified phase)
0.7736 Intermediate Similarity NPD1550 Clinical (unspecified phase)
0.773 Intermediate Similarity NPD5401 Approved
0.7727 Intermediate Similarity NPD7240 Approved
0.7722 Intermediate Similarity NPD8397 Clinical (unspecified phase)
0.7702 Intermediate Similarity NPD3750 Approved
0.7688 Intermediate Similarity NPD7852 Clinical (unspecified phase)
0.7674 Intermediate Similarity NPD3787 Discontinued
0.7647 Intermediate Similarity NPD3749 Approved
0.764 Intermediate Similarity NPD7421 Clinical (unspecified phase)
0.7622 Intermediate Similarity NPD7410 Clinical (unspecified phase)
0.7622 Intermediate Similarity NPD7004 Clinical (unspecified phase)
0.7616 Intermediate Similarity NPD6959 Discontinued
0.7616 Intermediate Similarity NPD9269 Phase 2
0.7613 Intermediate Similarity NPD3027 Phase 3
0.7592 Intermediate Similarity NPD8151 Discontinued
0.7588 Intermediate Similarity NPD7768 Phase 2
0.7564 Intermediate Similarity NPD6859 Clinical (unspecified phase)
0.7562 Intermediate Similarity NPD1551 Phase 2
0.7548 Intermediate Similarity NPD1529 Clinical (unspecified phase)
0.7532 Intermediate Similarity NPD1933 Approved
0.7529 Intermediate Similarity NPD5353 Approved
0.7515 Intermediate Similarity NPD4378 Clinical (unspecified phase)
0.75 Intermediate Similarity NPD1510 Phase 2
0.75 Intermediate Similarity NPD6599 Discontinued
0.7485 Intermediate Similarity NPD1878 Clinical (unspecified phase)
0.7484 Intermediate Similarity NPD1530 Clinical (unspecified phase)
0.7484 Intermediate Similarity NPD9494 Approved
0.7453 Intermediate Similarity NPD2796 Approved
0.744 Intermediate Similarity NPD5808 Clinical (unspecified phase)
0.7423 Intermediate Similarity NPD7783 Phase 2
0.7423 Intermediate Similarity NPD7782 Clinical (unspecified phase)
0.7421 Intermediate Similarity NPD447 Suspended
0.7421 Intermediate Similarity NPD7435 Discontinued
0.7421 Intermediate Similarity NPD7680 Approved
0.7405 Intermediate Similarity NPD6233 Phase 2
0.7394 Intermediate Similarity NPD7237 Clinical (unspecified phase)
0.7391 Intermediate Similarity NPD3748 Approved
0.7362 Intermediate Similarity NPD970 Clinical (unspecified phase)
0.7358 Intermediate Similarity NPD943 Approved
0.7358 Intermediate Similarity NPD7585 Approved
0.7354 Intermediate Similarity NPD6779 Approved
0.7354 Intermediate Similarity NPD6778 Approved
0.7354 Intermediate Similarity NPD6782 Approved
0.7354 Intermediate Similarity NPD6776 Approved
0.7354 Intermediate Similarity NPD6781 Approved
0.7354 Intermediate Similarity NPD6777 Approved
0.7354 Intermediate Similarity NPD6780 Approved
0.7351 Intermediate Similarity NPD9268 Approved
0.7337 Intermediate Similarity NPD7458 Discontinued
0.7333 Intermediate Similarity NPD7038 Approved
0.7333 Intermediate Similarity NPD7039 Approved
0.733 Intermediate Similarity NPD5242 Approved
0.732 Intermediate Similarity NPD1091 Approved
0.7306 Intermediate Similarity NPD7583 Approved
0.7251 Intermediate Similarity NPD6386 Approved
0.7251 Intermediate Similarity NPD6385 Approved
0.725 Intermediate Similarity NPD1240 Approved
0.7239 Intermediate Similarity NPD2935 Discontinued
0.7233 Intermediate Similarity NPD3764 Approved
0.7233 Intermediate Similarity NPD6798 Discontinued
0.7232 Intermediate Similarity NPD3926 Phase 2
0.7226 Intermediate Similarity NPD4379 Clinical (unspecified phase)
0.7216 Intermediate Similarity NPD8127 Discontinued
0.7216 Intermediate Similarity NPD7584 Approved
0.7215 Intermediate Similarity NPD4908 Phase 1
0.7213 Intermediate Similarity NPD7090 Clinical (unspecified phase)
0.7202 Intermediate Similarity NPD7870 Phase 2
0.7202 Intermediate Similarity NPD7871 Phase 2
0.7202 Intermediate Similarity NPD2532 Approved
0.7202 Intermediate Similarity NPD2533 Approved
0.7202 Intermediate Similarity NPD2534 Approved
0.72 Intermediate Similarity NPD919 Approved
0.7196 Intermediate Similarity NPD8090 Clinical (unspecified phase)
0.7194 Intermediate Similarity NPD7874 Approved
0.7194 Intermediate Similarity NPD7875 Clinical (unspecified phase)
0.7171 Intermediate Similarity NPD9545 Approved
0.7169 Intermediate Similarity NPD6398 Clinical (unspecified phase)
0.716 Intermediate Similarity NPD1607 Approved
0.716 Intermediate Similarity NPD6273 Approved
0.715 Intermediate Similarity NPD7696 Phase 3
0.715 Intermediate Similarity NPD7697 Approved
0.715 Intermediate Similarity NPD7698 Approved
0.7143 Intermediate Similarity NPD6971 Discontinued
0.7135 Intermediate Similarity NPD8434 Phase 2
0.7135 Intermediate Similarity NPD3226 Approved
0.7134 Intermediate Similarity NPD1203 Approved
0.7125 Intermediate Similarity NPD4907 Clinical (unspecified phase)
0.7117 Intermediate Similarity NPD7097 Phase 1
0.7108 Intermediate Similarity NPD6674 Discontinued
0.7108 Intermediate Similarity NPD1652 Phase 2
0.7098 Intermediate Similarity NPD6823 Phase 2
0.7092 Intermediate Similarity NPD7701 Phase 2
0.709 Intermediate Similarity NPD6535 Approved
0.709 Intermediate Similarity NPD6534 Approved
0.7088 Intermediate Similarity NPD5953 Discontinued
0.7083 Intermediate Similarity NPD7440 Discontinued
0.7079 Intermediate Similarity NPD7229 Phase 3
0.707 Intermediate Similarity NPD3225 Approved
0.7052 Intermediate Similarity NPD7615 Clinical (unspecified phase)
0.7051 Intermediate Similarity NPD1608 Approved
0.7043 Intermediate Similarity NPD8150 Discontinued
0.7035 Intermediate Similarity NPD3455 Phase 2
0.7026 Intermediate Similarity NPD8319 Approved
0.7026 Intermediate Similarity NPD8320 Phase 1
0.7022 Intermediate Similarity NPD1247 Approved
0.7018 Intermediate Similarity NPD920 Approved
0.7011 Intermediate Similarity NPD7549 Discontinued
0.7 Intermediate Similarity NPD642 Clinical (unspecified phase)
0.7 Intermediate Similarity NPD6832 Phase 2
0.6994 Remote Similarity NPD1899 Clinical (unspecified phase)
0.6994 Remote Similarity NPD5124 Phase 1
0.6994 Remote Similarity NPD5123 Clinical (unspecified phase)
0.6985 Remote Similarity NPD7801 Approved
0.6979 Remote Similarity NPD7699 Phase 2
0.6979 Remote Similarity NPD7700 Phase 2
0.6978 Remote Similarity NPD7286 Phase 2
0.697 Remote Similarity NPD7033 Discontinued
0.697 Remote Similarity NPD651 Clinical (unspecified phase)
0.6964 Remote Similarity NPD8166 Discontinued
0.6941 Remote Similarity NPD4357 Discontinued
0.6932 Remote Similarity NPD4288 Approved
0.6928 Remote Similarity NPD6100 Approved
0.6928 Remote Similarity NPD6099 Approved
0.6927 Remote Similarity NPD8155 Clinical (unspecified phase)
0.6914 Remote Similarity NPD2313 Discontinued
0.6907 Remote Similarity NPD7501 Clinical (unspecified phase)
0.689 Remote Similarity NPD6355 Discontinued
0.6886 Remote Similarity NPD2346 Discontinued
0.6882 Remote Similarity NPD643 Clinical (unspecified phase)
0.6879 Remote Similarity NPD1610 Phase 2
0.6879 Remote Similarity NPD422 Phase 1
0.6871 Remote Similarity NPD4062 Phase 3
0.6867 Remote Similarity NPD2799 Discontinued
0.6867 Remote Similarity NPD4308 Phase 3
0.6864 Remote Similarity NPD4110 Phase 3
0.6864 Remote Similarity NPD4109 Clinical (unspecified phase)

Structure

External Identifiers

PubChem CID   11330189
ChEMBL   CHEMBL480304
ZINC  

Physicochemical Properties

Molecular Weight:  542.14
ALogP:  -3.6717
MLogP:  3.11
XLogP:  2.721
# Rotatable Bonds:  16
Polar Surface Area:  206.6
# H-Bond Aceptor:  6
# H-Bond Donor:  8
# Rings:  4
# Heavy Atoms:  39

Download Data

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Biological Activities  
Similar NPs/Drugs