Natural Product: NPC221870

Natural Product ID:  NPC221870
Common Name:   Eucomic Acid
IUPAC Name:   (2R)-2-hydroxy-2-[(4-hydroxyphenyl)methyl]butanedioic acid
Synonyms:   Eucomic acid
Molecular Formula:   C11H12O6
Standard InCHIKey:  XLGKDRSWPCQYAB-LLVKDONJSA-N
Standard InCHI:  InChI=1S/C11H12O6/c12-8-3-1-7(2-4-8)5-11(17,10(15)16)6-9(13)14/h1-4,12,17H,5-6H2,(H,13,14)(H,15,16)/t11-/m1/s1
Canonical SMILES:  OC(=O)C[C@@](C(=O)O)(Cc1ccc(cc1)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
NPO10865 Sextonia rubra Species Lauraceae Eukaryota UNPD*
NPO13504 Lotus japonicus Species Fabaceae Eukaryota PMID[21510636]
NPO25544 Encyclia michuacana Species Orchidaceae Eukaryota PMID[21510636]
NPO23191 Plectranthus striatus Species Lamiaceae Eukaryota UNPD*
NPO27843 Lycoris radiata Species Amaryllidaceae Eukaryota PMID[21510636]
NPO12069 Isaria felina Species Cordycipitaceae Eukaryota UNPD*
NPO30278 Cattleya trianaei Species Orchidaceae Eukaryota PMID[21510636]
NPO30423 Vanda teres Species Orchidaceae Eukaryota Stems PMID[21510636]
NPO3542 Eucomis punctata Species Hyacinthaceae Eukaryota bulb PMID[21510636]
NPO10012 Triaenophora rupestris Species Orobanchaceae Eukaryota UNPD*
NPO7169 Nama hispidum Species Namaceae Eukaryota UNPD*
NPO12234 Khaya ivorensis Species Meliaceae Eukaryota UNPD*
NPO1661 Bartramia pomiformis Species Bartramiaceae Eukaryota UNPD*
NPO7752 Beilschmiedia anacardioides Species Lauraceae Eukaryota UNPD*
NPO3458 Lupinus verbasciformis Species Fabaceae Eukaryota UNPD*
NPO21498 Coccus ilicis Species Coccidae Eukaryota UNPD*
NPO14200 Aristolochia zollingeriana Species Aristolochiaceae Eukaryota UNPD*
NPO12061 Justicia paniculata Species Acanthaceae Eukaryota UNPD*
NPO12414 Penicillium paxilli Species Aspergillaceae Eukaryota UNPD*
NPO12585 Craspidospermum verticillatum Species Apocynaceae Eukaryota UNPD*
NPO14615 Streptomyces paulus Species Streptomycetaceae Bacteria UNPD*
NPO6179 Aframomum amaniense Species Zingiberaceae Eukaryota UNPD*
NPO12910 Ixeris stolonifera Species Asteraceae Eukaryota UNPD*
NPO13907 Senecio renardii Species Asteraceae Eukaryota UNPD*
NPO25715 Senna siamea Species Fabaceae Eukaryota UNPD*
NPO14289 Pieris napi Species Pieridae Eukaryota UNPD*
NPO22024 Agathosma serpyllacea Species Rutaceae Eukaryota UNPD*
NPO14089 Hypericum ascyron Species Hypericaceae Eukaryota UNPD*
NPO1103 Dioscorea japonica Species Dioscoreaceae Eukaryota UNPD*
NPO9669 Dictyopteris acrostichoides Species Dictyotaceae Eukaryota UNPD*
NPO11882 Cedrus libani Species Pinaceae Eukaryota UNPD*
NPO14504 Alectoria divergens Species Parmeliaceae Eukaryota UNPD*
NPO13076 Cephalaria grossheimii Species Caprifoliaceae Eukaryota UNPD*
NPO6774 Khaya senegalensis Species Meliaceae Eukaryota UNPD*
NPO20125 Cleistanthus schlechteri Species Phyllanthaceae Eukaryota UNPD*
NPO10389 Larix cajanderi Species Pinaceae Eukaryota UNPD*
NPO13504 Lotus japonicus Species Fabaceae Eukaryota UNPD*
NPO2130 Ehretia dicksonii Species Ehretiaceae Eukaryota UNPD*
NPO12754 Cerinthe minor Species Boraginaceae Eukaryota UNPD*
NPO25774 Virola multinervia Species Myristicaceae Eukaryota UNPD*
NPO13701 Melaleuca rhaphiophylla Species Myrtaceae Eukaryota UNPD*
NPO22965 Saussurea elegans Species Asteraceae Eukaryota UNPD*
NPO3199 Balanophora involucrata Species Balanophoraceae Eukaryota UNPD*

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT2 Others Unspecified FC = 60 21510636

  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 NPC221870 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
0.9636 High Similarity NPC104514
0.8818 High Similarity NPC326187
0.8796 High Similarity NPC13495
0.8679 High Similarity NPC245561
0.8598 High Similarity NPC52472
0.8584 High Similarity NPC48525
0.8571 High Similarity NPC469927
0.8571 High Similarity NPC222084
0.8548 High Similarity NPC108553
0.844 Intermediate Similarity NPC13426
0.8348 Intermediate Similarity NPC148969
0.8347 Intermediate Similarity NPC236981
0.8305 Intermediate Similarity NPC63126
0.8279 Intermediate Similarity NPC231767
0.8264 Intermediate Similarity NPC68167
0.8241 Intermediate Similarity NPC260000
0.8205 Intermediate Similarity NPC4665
0.8165 Intermediate Similarity NPC280869
0.8154 Intermediate Similarity NPC279676
0.8154 Intermediate Similarity NPC67349
0.8099 Intermediate Similarity NPC164852
0.807 Intermediate Similarity NPC31274
0.807 Intermediate Similarity NPC317305
0.8065 Intermediate Similarity NPC127975
0.8053 Intermediate Similarity NPC188677
0.8053 Intermediate Similarity NPC317592
0.8049 Intermediate Similarity NPC14141
0.8036 Intermediate Similarity NPC261573
0.8036 Intermediate Similarity NPC120693
0.8036 Intermediate Similarity NPC8931
0.8033 Intermediate Similarity NPC322332
0.803 Intermediate Similarity NPC59775
0.803 Intermediate Similarity NPC256162
0.803 Intermediate Similarity NPC179505
0.803 Intermediate Similarity NPC156709
0.8017 Intermediate Similarity NPC177576
0.7967 Intermediate Similarity NPC283514
0.7953 Intermediate Similarity NPC214246
0.7951 Intermediate Similarity NPC165197
0.7949 Intermediate Similarity NPC17693
0.7931 Intermediate Similarity NPC21162
0.7931 Intermediate Similarity NPC321252
0.7931 Intermediate Similarity NPC252544
0.792 Intermediate Similarity NPC132921
0.7903 Intermediate Similarity NPC477153
0.7895 Intermediate Similarity NPC70843
0.7895 Intermediate Similarity NPC187913
0.7886 Intermediate Similarity NPC198336
0.7886 Intermediate Similarity NPC25168
0.7881 Intermediate Similarity NPC309808
0.7874 Intermediate Similarity NPC217431
0.7869 Intermediate Similarity NPC265454
0.7869 Intermediate Similarity NPC34634
0.7869 Intermediate Similarity NPC260837
0.7857 Intermediate Similarity NPC251407
0.7857 Intermediate Similarity NPC475695
0.7857 Intermediate Similarity NPC168653
0.7851 Intermediate Similarity NPC311091
0.7851 Intermediate Similarity NPC471033
0.7845 Intermediate Similarity NPC88141
0.7833 Intermediate Similarity NPC471924
0.7833 Intermediate Similarity NPC28951
0.7833 Intermediate Similarity NPC325646
0.7833 Intermediate Similarity NPC471925
0.7833 Intermediate Similarity NPC471928
0.7833 Intermediate Similarity NPC312800
0.7826 Intermediate Similarity NPC228737
0.7823 Intermediate Similarity NPC297193
0.7823 Intermediate Similarity NPC139171
0.7815 Intermediate Similarity NPC285350
0.7805 Intermediate Similarity NPC98305
0.7798 Intermediate Similarity NPC81010
0.7798 Intermediate Similarity NPC32977
0.7797 Intermediate Similarity NPC286222
0.7794 Intermediate Similarity NPC32
0.7794 Intermediate Similarity NPC304956
0.7794 Intermediate Similarity NPC122491
0.7788 Intermediate Similarity NPC470202
0.7787 Intermediate Similarity NPC184579
0.7787 Intermediate Similarity NPC472593
0.7787 Intermediate Similarity NPC233165
0.7787 Intermediate Similarity NPC182240
0.7787 Intermediate Similarity NPC156654
0.7778 Intermediate Similarity NPC287473
0.7769 Intermediate Similarity NPC160199
0.7769 Intermediate Similarity NPC325295
0.7769 Intermediate Similarity NPC471926
0.7769 Intermediate Similarity NPC76308
0.7769 Intermediate Similarity NPC125252
0.7759 Intermediate Similarity NPC100551
0.775 Intermediate Similarity NPC23402
0.7748 Intermediate Similarity NPC160548
0.7748 Intermediate Similarity NPC210529
0.7748 Intermediate Similarity NPC175852
0.7742 Intermediate Similarity NPC472271
0.7742 Intermediate Similarity NPC177291
0.7742 Intermediate Similarity NPC31936
0.7742 Intermediate Similarity NPC194416
0.7739 Intermediate Similarity NPC1075
0.7739 Intermediate Similarity NPC69332
0.7739 Intermediate Similarity NPC95178
0.7739 Intermediate Similarity NPC29989
0.7739 Intermediate Similarity NPC294902
0.7739 Intermediate Similarity NPC1786
0.7737 Intermediate Similarity NPC53884
0.7737 Intermediate Similarity NPC258671
0.7731 Intermediate Similarity NPC211421
0.7731 Intermediate Similarity NPC109241
0.7727 Intermediate Similarity NPC470990
0.7724 Intermediate Similarity NPC473136
0.7717 Intermediate Similarity NPC147192
0.7717 Intermediate Similarity NPC473751
0.7712 Intermediate Similarity NPC212718
0.7712 Intermediate Similarity NPC114682
0.7712 Intermediate Similarity NPC228609
0.771 Intermediate Similarity NPC471749
0.7705 Intermediate Similarity NPC328694
0.7698 Intermediate Similarity NPC117794
0.7698 Intermediate Similarity NPC471927
0.7692 Intermediate Similarity NPC234639
0.7692 Intermediate Similarity NPC198249
0.7692 Intermediate Similarity NPC95172
0.7686 Intermediate Similarity NPC277394
0.7686 Intermediate Similarity NPC128249
0.7686 Intermediate Similarity NPC299252
0.7686 Intermediate Similarity NPC61062
0.768 Intermediate Similarity NPC86900
0.7672 Intermediate Similarity NPC29883
0.7672 Intermediate Similarity NPC34715
0.7672 Intermediate Similarity NPC226699
0.7667 Intermediate Similarity NPC81808
0.7664 Intermediate Similarity NPC474692
0.7661 Intermediate Similarity NPC272454
0.7661 Intermediate Similarity NPC35856
0.7661 Intermediate Similarity NPC294361
0.7661 Intermediate Similarity NPC159760
0.7661 Intermediate Similarity NPC178395
0.7661 Intermediate Similarity NPC179092
0.7661 Intermediate Similarity NPC26433
0.7661 Intermediate Similarity NPC292665
0.7661 Intermediate Similarity NPC244994
0.7661 Intermediate Similarity NPC236520
0.7661 Intermediate Similarity NPC222876
0.7661 Intermediate Similarity NPC301987
0.7661 Intermediate Similarity NPC115188
0.7652 Intermediate Similarity NPC303141
0.7652 Intermediate Similarity NPC68517
0.7642 Intermediate Similarity NPC42657
0.7642 Intermediate Similarity NPC160235
0.7638 Intermediate Similarity NPC472592
0.763 Intermediate Similarity NPC147379
0.7627 Intermediate Similarity NPC63345
0.7626 Intermediate Similarity NPC143892
0.7626 Intermediate Similarity NPC229264
0.7626 Intermediate Similarity NPC221383
0.7626 Intermediate Similarity NPC283081
0.7626 Intermediate Similarity NPC299090
0.7623 Intermediate Similarity NPC150919
0.7615 Intermediate Similarity NPC217052
0.7615 Intermediate Similarity NPC45040
0.7615 Intermediate Similarity NPC329344
0.7615 Intermediate Similarity NPC237506
0.7615 Intermediate Similarity NPC32626
0.7615 Intermediate Similarity NPC304541
0.7612 Intermediate Similarity NPC308976
0.7607 Intermediate Similarity NPC224584
0.7603 Intermediate Similarity NPC161304
0.7603 Intermediate Similarity NPC210531
0.7603 Intermediate Similarity NPC240163
0.7597 Intermediate Similarity NPC95537
0.7597 Intermediate Similarity NPC158673
0.7594 Intermediate Similarity NPC182217
0.7594 Intermediate Similarity NPC72918
0.7594 Intermediate Similarity NPC233350
0.7594 Intermediate Similarity NPC70680
0.7593 Intermediate Similarity NPC242240
0.7593 Intermediate Similarity NPC258219
0.7593 Intermediate Similarity NPC318325
0.7593 Intermediate Similarity NPC123273
0.7589 Intermediate Similarity NPC109955
0.7586 Intermediate Similarity NPC6984
0.7586 Intermediate Similarity NPC184658
0.7583 Intermediate Similarity NPC264558
0.7583 Intermediate Similarity NPC98543
0.7583 Intermediate Similarity NPC11824
0.7583 Intermediate Similarity NPC223004
0.7578 Intermediate Similarity NPC321561
0.7576 Intermediate Similarity NPC215484
0.7576 Intermediate Similarity NPC202743
0.757 Intermediate Similarity NPC23167
0.7568 Intermediate Similarity NPC246679
0.7568 Intermediate Similarity NPC274678
0.7568 Intermediate Similarity NPC257182
0.7565 Intermediate Similarity NPC471511
0.7565 Intermediate Similarity NPC93831
0.7563 Intermediate Similarity NPC470355
0.7561 Intermediate Similarity NPC241089
0.7561 Intermediate Similarity NPC474890
0.7561 Intermediate Similarity NPC86198
0.7561 Intermediate Similarity NPC205502

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC221870 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
0.7759 Intermediate Similarity NPD74 Approved
0.7759 Intermediate Similarity NPD9266 Approved
0.775 Intermediate Similarity NPD256 Approved
0.775 Intermediate Similarity NPD255 Approved
0.7748 Intermediate Similarity NPD9495 Approved
0.7672 Intermediate Similarity NPD9265 Clinical (unspecified phase)
0.7672 Intermediate Similarity NPD9267 Approved
0.7672 Intermediate Similarity NPD9263 Approved
0.7672 Intermediate Similarity NPD9264 Approved
0.7638 Intermediate Similarity NPD1164 Approved
0.7578 Intermediate Similarity NPD258 Approved
0.7578 Intermediate Similarity NPD257 Approved
0.7541 Intermediate Similarity NPD9493 Approved
0.7541 Intermediate Similarity NPD9568 Approved
0.754 Intermediate Similarity NPD9269 Phase 2
0.7477 Intermediate Similarity NPD1432 Clinical (unspecified phase)
0.746 Intermediate Similarity NPD1535 Discovery
0.7419 Intermediate Similarity NPD1759 Phase 1
0.7411 Intermediate Similarity NPD2860 Approved
0.7411 Intermediate Similarity NPD2859 Approved
0.7407 Intermediate Similarity NPD651 Clinical (unspecified phase)
0.7402 Intermediate Similarity NPD1481 Phase 2
0.7398 Intermediate Similarity NPD405 Clinical (unspecified phase)
0.7385 Intermediate Similarity NPD9569 Approved
0.7377 Intermediate Similarity NPD9281 Approved
0.7368 Intermediate Similarity NPD943 Approved
0.7368 Intermediate Similarity NPD3020 Approved
0.736 Intermediate Similarity NPD9268 Approved
0.7353 Intermediate Similarity NPD9570 Approved
0.7348 Intermediate Similarity NPD3764 Approved
0.7339 Intermediate Similarity NPD1758 Phase 1
0.7328 Intermediate Similarity NPD9261 Approved
0.7321 Intermediate Similarity NPD2934 Approved
0.7321 Intermediate Similarity NPD2933 Approved
0.7293 Intermediate Similarity NPD6233 Phase 2
0.729 Intermediate Similarity NPD111 Approved
0.728 Intermediate Similarity NPD9545 Approved
0.725 Intermediate Similarity NPD3021 Approved
0.725 Intermediate Similarity NPD3022 Approved
0.7241 Intermediate Similarity NPD846 Approved
0.7241 Intermediate Similarity NPD940 Approved
0.7239 Intermediate Similarity NPD825 Approved
0.7239 Intermediate Similarity NPD826 Approved
0.7236 Intermediate Similarity NPD690 Clinical (unspecified phase)
0.7231 Intermediate Similarity NPD1470 Approved
0.7226 Intermediate Similarity NPD2935 Discontinued
0.7218 Intermediate Similarity NPD6798 Discontinued
0.7214 Intermediate Similarity NPD6190 Approved
0.7185 Intermediate Similarity NPD274 Approved
0.7185 Intermediate Similarity NPD6355 Discontinued
0.7185 Intermediate Similarity NPD230 Phase 1
0.7185 Intermediate Similarity NPD275 Approved
0.7165 Intermediate Similarity NPD3019 Approved
0.7165 Intermediate Similarity NPD2932 Approved
0.7164 Intermediate Similarity NPD259 Phase 1
0.7155 Intermediate Similarity NPD289 Clinical (unspecified phase)
0.7143 Intermediate Similarity NPD9537 Phase 1
0.7143 Intermediate Similarity NPD7095 Approved
0.7143 Intermediate Similarity NPD9536 Phase 1
0.7132 Intermediate Similarity NPD9717 Approved
0.7105 Intermediate Similarity NPD844 Approved
0.7103 Intermediate Similarity NPD9491 Approved
0.7099 Intermediate Similarity NPD987 Approved
0.7099 Intermediate Similarity NPD1203 Approved
0.7097 Intermediate Similarity NPD2629 Approved
0.7075 Intermediate Similarity NPD226 Approved
0.7059 Intermediate Similarity NPD555 Phase 2
0.7059 Intermediate Similarity NPD447 Suspended
0.7054 Intermediate Similarity NPD1201 Approved
0.7043 Intermediate Similarity NPD288 Approved
0.7037 Intermediate Similarity NPD4062 Phase 3
0.7023 Intermediate Similarity NPD1283 Approved
0.7021 Intermediate Similarity NPD3400 Discontinued
0.7009 Intermediate Similarity NPD1242 Phase 1
0.7008 Intermediate Similarity NPD1894 Discontinued
0.6978 Remote Similarity NPD5408 Approved
0.6978 Remote Similarity NPD5406 Approved
0.6978 Remote Similarity NPD5404 Approved
0.6978 Remote Similarity NPD5405 Approved
0.6977 Remote Similarity NPD3847 Discontinued
0.6964 Remote Similarity NPD9258 Approved
0.6964 Remote Similarity NPD9256 Approved
0.6963 Remote Similarity NPD2313 Discontinued
0.6957 Remote Similarity NPD1809 Phase 2
0.693 Remote Similarity NPD845 Approved
0.6917 Remote Similarity NPD5647 Approved
0.6912 Remote Similarity NPD6663 Approved
0.6906 Remote Similarity NPD2799 Discontinued
0.6906 Remote Similarity NPD3299 Clinical (unspecified phase)
0.6906 Remote Similarity NPD1509 Clinical (unspecified phase)
0.6875 Remote Similarity NPD800 Approved
0.687 Remote Similarity NPD1608 Approved
0.6866 Remote Similarity NPD5736 Approved
0.6861 Remote Similarity NPD4060 Phase 1
0.6855 Remote Similarity NPD228 Approved
0.6842 Remote Similarity NPD2797 Approved
0.6833 Remote Similarity NPD1237 Approved
0.6829 Remote Similarity NPD2067 Discontinued
0.6822 Remote Similarity NPD4102 Approved
0.6822 Remote Similarity NPD4196 Clinical (unspecified phase)
0.6822 Remote Similarity NPD4105 Approved
0.6815 Remote Similarity NPD2614 Approved
0.6814 Remote Similarity NPD1086 Approved
0.6814 Remote Similarity NPD1090 Approved
0.6814 Remote Similarity NPD1089 Approved
0.6806 Remote Similarity NPD3300 Phase 2
0.68 Remote Similarity NPD7972 Discontinued
0.68 Remote Similarity NPD9377 Approved
0.68 Remote Similarity NPD9379 Approved
0.6794 Remote Similarity NPD1281 Approved
0.6792 Remote Similarity NPD225 Approved
0.6792 Remote Similarity NPD227 Approved
0.6788 Remote Similarity NPD520 Approved
0.6786 Remote Similarity NPD1510 Phase 2
0.6783 Remote Similarity NPD8166 Discontinued
0.6783 Remote Similarity NPD1878 Clinical (unspecified phase)
0.6781 Remote Similarity NPD1512 Approved
0.6774 Remote Similarity NPD9280 Clinical (unspecified phase)
0.6772 Remote Similarity NPD4198 Discontinued
0.6769 Remote Similarity NPD5306 Approved
0.6769 Remote Similarity NPD5305 Approved
0.6767 Remote Similarity NPD196 Phase 1
0.6765 Remote Similarity NPD3136 Phase 2
0.6761 Remote Similarity NPD970 Clinical (unspecified phase)
0.6761 Remote Similarity NPD5958 Discontinued
0.6761 Remote Similarity NPD4534 Discontinued
0.6754 Remote Similarity NPD1239 Approved
0.6748 Remote Similarity NPD6831 Clinical (unspecified phase)
0.6746 Remote Similarity NPD2228 Approved
0.6746 Remote Similarity NPD2229 Approved
0.6746 Remote Similarity NPD2234 Approved
0.6741 Remote Similarity NPD9494 Approved
0.6739 Remote Similarity NPD1240 Approved
0.6736 Remote Similarity NPD2354 Approved
0.6729 Remote Similarity NPD9490 Approved
0.6724 Remote Similarity NPD688 Clinical (unspecified phase)
0.6724 Remote Similarity NPD1693 Approved
0.6718 Remote Similarity NPD4136 Approved
0.6718 Remote Similarity NPD3026 Approved
0.6718 Remote Similarity NPD4106 Approved
0.6718 Remote Similarity NPD4135 Approved
0.6718 Remote Similarity NPD3023 Approved
0.6715 Remote Similarity NPD6859 Clinical (unspecified phase)
0.6715 Remote Similarity NPD411 Approved
0.6715 Remote Similarity NPD3268 Approved
0.6714 Remote Similarity NPD7097 Phase 1
0.6712 Remote Similarity NPD4378 Clinical (unspecified phase)
0.6696 Remote Similarity NPD1088 Approved
0.6696 Remote Similarity NPD4793 Discontinued
0.6694 Remote Similarity NPD9610 Approved
0.6694 Remote Similarity NPD164 Approved
0.6694 Remote Similarity NPD9608 Approved
0.6692 Remote Similarity NPD3025 Approved
0.6692 Remote Similarity NPD3024 Approved
0.6692 Remote Similarity NPD1755 Approved
0.669 Remote Similarity NPD2344 Approved
0.6667 Remote Similarity NPD1358 Approved
0.6667 Remote Similarity NPD7033 Discontinued
0.6667 Remote Similarity NPD3750 Approved
0.6667 Remote Similarity NPD4807 Approved
0.6667 Remote Similarity NPD4806 Approved
0.6667 Remote Similarity NPD4628 Phase 3
0.6667 Remote Similarity NPD5729 Clinical (unspecified phase)
0.6667 Remote Similarity NPD7075 Discontinued
0.6667 Remote Similarity NPD422 Phase 1
0.6667 Remote Similarity NPD4308 Phase 3
0.6667 Remote Similarity NPD5535 Approved
0.6644 Remote Similarity NPD1511 Approved
0.6644 Remote Similarity NPD6799 Approved
0.6643 Remote Similarity NPD6653 Approved
0.6643 Remote Similarity NPD1607 Approved
0.6642 Remote Similarity NPD2598 Clinical (unspecified phase)
0.6641 Remote Similarity NPD17 Approved
0.6641 Remote Similarity NPD4626 Approved
0.6639 Remote Similarity NPD5048 Discontinued
0.6638 Remote Similarity NPD1202 Approved
0.6638 Remote Similarity NPD5122 Clinical (unspecified phase)
0.662 Remote Similarity NPD1551 Phase 2
0.662 Remote Similarity NPD1519 Approved
0.662 Remote Similarity NPD1537 Approved
0.662 Remote Similarity NPD1538 Phase 1
0.6618 Remote Similarity NPD454 Approved
0.6614 Remote Similarity NPD1241 Discontinued
0.6613 Remote Similarity NPD2684 Approved
0.6612 Remote Similarity NPD5738 Clinical (unspecified phase)
0.6607 Remote Similarity NPD9257 Approved
0.6607 Remote Similarity NPD9259 Approved
0.6593 Remote Similarity NPD3094 Phase 2
0.6587 Remote Similarity NPD969 Suspended
0.6585 Remote Similarity NPD1445 Approved
0.6585 Remote Similarity NPD1444 Approved
0.6583 Remote Similarity NPD3028 Approved
0.6579 Remote Similarity NPD5347 Phase 2
0.6579 Remote Similarity NPD5346 Phase 2
0.6579 Remote Similarity NPD7096 Clinical (unspecified phase)
0.6573 Remote Similarity NPD1550 Clinical (unspecified phase)
0.6573 Remote Similarity NPD7978 Discontinued
0.6573 Remote Similarity NPD1552 Clinical (unspecified phase)
0.6573 Remote Similarity NPD2346 Discontinued
0.6567 Remote Similarity NPD4379 Clinical (unspecified phase)

Structure

External Identifiers

PubChem CID   23757219
ChEMBL   CHEMBL1801775
ZINC  

Physicochemical Properties

Molecular Weight:  240.06
ALogP:  -1.3291
MLogP:  2.01
XLogP:  -0.117
# Rotatable Bonds:  9
Polar Surface Area:  115.06
# H-Bond Aceptor:  5
# H-Bond Donor:  4
# Rings:  1
# Heavy Atoms:  17

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Biological Activities  
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