Natural Product: NPC102280

Natural Product ID:  NPC102280
Common Name:   n.a.
IUPAC Name:  
Synonyms:  
Molecular Formula:   C30H24O10
Standard InCHIKey:  LQRHGTVFFPMWCG-BDHPMLJSSA-N
Standard InCHI:  InChI=1S/C30H24O10/c31-15-5-1-13(2-6-15)27-21(36)11-18-19(34)12-23-25(28(18)38-27)26-24-20(35)9-17(33)10-22(24)39-30(40-23,29(26)37)14-3-7-16(32)8-4-14/h1-10,12,21,26-27,29,31-37H,11H2/t21-,26+,27+,29+,30-/m1/s1
Canonical SMILES:  Oc1ccc(cc1)[C@@H]1Oc2c(C[C@H]1O)c(O)cc1c2[C@@H]2c3c(O)cc(cc3O[C@](O1)([C@H]2O)c1ccc(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
NPO651 Aconitum vilmorinianum Species Ranunculaceae Eukaryota UNPD*
NPO6978 Boronella koniambiensis Species Rutaceae Eukaryota UNPD*
NPO4795 Prunus armeniaca Species Rosaceae Eukaryota UNPD*
NPO10452 Odontites rubra Species Orobanchaceae Eukaryota UNPD*
NPO11376 Schistostephium rotundifolium Species Asteraceae Eukaryota UNPD*
NPO3697 Ongokea klaineana Species Aptandraceae Eukaryota UNPD*
NPO16625 Phalaenopsis aphrodite Species Orchidaceae Eukaryota UNPD*
NPO14747 Usnea florida Species Parmeliaceae Eukaryota UNPD*
NPO15312 Coelogorgia palmosa Species Coelogorgiidae Eukaryota UNPD*
NPO32897 spenceria ramalana Species Rosaceae Eukaryota PMID[24131240]
NPO5482 Gymnanthemum amygdalinum Species Asteraceae Eukaryota UNPD*
NPO7718 Peucedanum palustre Species Apiaceae Eukaryota UNPD*
NPO13427 Erinaceus europaeus Species Erinaceidae Eukaryota UNPD*
NPO16541 Veratrum stenophyllum Species Melanthiaceae Eukaryota UNPD*
NPO1723 Sideritis syriaca Species Lamiaceae Eukaryota UNPD*
NPO16307 Murraya kwangsiensis Species Rutaceae Eukaryota UNPD*
NPO15570 Plectranthus mollis Species Lamiaceae Eukaryota UNPD*
NPO2607 Ophiorrhiza blumeana Species Rubiaceae Eukaryota UNPD*
NPO12951 Talaromyces coalescens Species Trichocomaceae Eukaryota UNPD*
NPO8671 Physalis solanaceus Species Solanaceae Eukaryota UNPD*
NPO13952 Streptomyces lavendulae Species Streptomycetaceae Bacteria UNPD*
NPO12547 Viburnum chingii Species Adoxaceae Eukaryota UNPD*
NPO13740 Aconitum kamtschaticum Species Ranunculaceae Eukaryota UNPD*
NPO22056.1 Streptomyces fervens Subspecies Streptomycetaceae Bacteria UNPD*
NPO9386 Ectropis bicolor Species Geometridae Eukaryota UNPD*
NPO14914 Esox saurus Species Esocidae Eukaryota UNPD*
NPO16311 Rusavskia elegans Species Teloschistaceae Eukaryota UNPD*
NPO7792 Coreopsis grandiflora Species Asteraceae Eukaryota UNPD*
NPO26256 Zanthoxylum chiriquinum Species Rutaceae Eukaryota UNPD*
NPO15178 Psychotria bahiensis Species Rubiaceae Eukaryota UNPD*
NPO14111 Maytenus serrata Species Celastraceae Eukaryota UNPD*
NPO15159 Podocarpus salignus Species Podocarpaceae Eukaryota UNPD*
NPO22053 Vepris pilosa Species Rutaceae Eukaryota UNPD*
NPO12457 Siphocampylus verticillatus Species Campanulaceae Eukaryota UNPD*
NPO10899 Ophioparma ventosa Species Ophioparmaceae Eukaryota UNPD*
NPO11644 Prosopis ruscifolia Species Fabaceae Eukaryota UNPD*
NPO13582 Leucopaxillus giganteus Species Tricholomataceae Eukaryota UNPD*
NPO14442 Gouania microcarpa Species Gobiesocidae Eukaryota UNPD*
NPO15434 Rhodomicrobium vannielii Species Hyphomicrobiaceae Bacteria UNPD*
NPO16109 Actinidia kolomikta Species Actinidiaceae Eukaryota UNPD*
NPO15679 Amyris marshii Species Rutaceae Eukaryota UNPD*
NPO4795 Prunus armeniaca Species Rosaceae Eukaryota TCM_Taiwan*
NPO4083 Brevibacillus laterosporus Species Paenibacillaceae Bacteria UNPD*
NPO12470 Brachyspira hyodysenteriae Species Brachyspiraceae Bacteria UNPD*
NPO15884 Dodonaea polyandra Species Sapindaceae Eukaryota UNPD*
NPO7077 Canarium strictum Species Burseraceae Eukaryota UNPD*
NPO11962 Garcinia macrophylla Species Clusiaceae Eukaryota UNPD*
NPO14604 Dipteronia dyeriana Species Aceraceae Eukaryota UNPD*
NPO5750 Monomorium floricola Species Formicidae Eukaryota UNPD*
NPO13273 Maytenus loeseneri Species Celastraceae Eukaryota UNPD*

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT2 Others Unspecified IC50 = 34700 nM 24131240

  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 NPC102280 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 NPC155564
1.0 High Similarity NPC248053
0.965 High Similarity NPC471403
0.965 High Similarity NPC259707
0.9638 High Similarity NPC100482
0.9638 High Similarity NPC277331
0.9583 High Similarity NPC272552
0.9583 High Similarity NPC226108
0.9583 High Similarity NPC46283
0.9583 High Similarity NPC322899
0.9583 High Similarity NPC134911
0.9583 High Similarity NPC44192
0.9583 High Similarity NPC469944
0.9433 High Similarity NPC475492
0.9384 High Similarity NPC306267
0.9384 High Similarity NPC20050
0.9315 High Similarity NPC59692
0.9262 High Similarity NPC73517
0.9262 High Similarity NPC147743
0.9262 High Similarity NPC4809
0.9236 High Similarity NPC262911
0.9236 High Similarity NPC294558
0.9236 High Similarity NPC170103
0.9236 High Similarity NPC70409
0.9236 High Similarity NPC204770
0.9236 High Similarity NPC108811
0.9236 High Similarity NPC202742
0.9236 High Similarity NPC18185
0.9236 High Similarity NPC263940
0.9236 High Similarity NPC58190
0.9236 High Similarity NPC236202
0.9236 High Similarity NPC82917
0.92 High Similarity NPC106601
0.92 High Similarity NPC212614
0.92 High Similarity NPC205613
0.92 High Similarity NPC151474
0.92 High Similarity NPC185231
0.92 High Similarity NPC159526
0.92 High Similarity NPC86630
0.92 High Similarity NPC471404
0.9167 High Similarity NPC96576
0.9161 High Similarity NPC225445
0.911 High Similarity NPC211561
0.9091 High Similarity NPC116922
0.9054 High Similarity NPC226809
0.9054 High Similarity NPC233467
0.9054 High Similarity NPC279406
0.9041 High Similarity NPC227516
0.9041 High Similarity NPC20757
0.9028 High Similarity NPC177597
0.9021 High Similarity NPC472353
0.9021 High Similarity NPC5253
0.9021 High Similarity NPC128337
0.9021 High Similarity NPC139976
0.9021 High Similarity NPC230718
0.9021 High Similarity NPC49542
0.9021 High Similarity NPC84207
0.902 High Similarity NPC12326
0.9007 High Similarity NPC470307
0.9007 High Similarity NPC470308
0.9007 High Similarity NPC87777
0.9007 High Similarity NPC262328
0.8993 High Similarity NPC224161
0.8951 High Similarity NPC108674
0.8944 High Similarity NPC475836
0.8936 High Similarity NPC471522
0.8933 High Similarity NPC46335
0.8929 High Similarity NPC476616
0.8929 High Similarity NPC476617
0.8929 High Similarity NPC476615
0.8919 High Similarity NPC477612
0.8897 High Similarity NPC28440
0.8897 High Similarity NPC171932
0.8865 High Similarity NPC79957
0.8849 High Similarity NPC103799
0.8844 High Similarity NPC473480
0.8844 High Similarity NPC15538
0.8819 High Similarity NPC178054
0.8784 High Similarity NPC280945
0.8776 High Similarity NPC74320
0.8776 High Similarity NPC107120
0.8776 High Similarity NPC215678
0.8776 High Similarity NPC274454
0.8767 High Similarity NPC168579
0.8767 High Similarity NPC76176
0.8767 High Similarity NPC138227
0.8767 High Similarity NPC469313
0.8766 High Similarity NPC100936
0.8766 High Similarity NPC1253
0.8732 High Similarity NPC125579
0.8723 High Similarity NPC92805
0.8716 High Similarity NPC153182
0.8716 High Similarity NPC174251
0.8707 High Similarity NPC23807
0.8699 High Similarity NPC37793
0.869 High Similarity NPC5155
0.869 High Similarity NPC210192
0.8671 High Similarity NPC262585
0.8671 High Similarity NPC18189
0.8671 High Similarity NPC20829
0.8662 High Similarity NPC188555
0.8662 High Similarity NPC117048
0.8662 High Similarity NPC130496
0.8662 High Similarity NPC124085
0.8649 High Similarity NPC125755
0.8639 High Similarity NPC151704
0.8633 High Similarity NPC53986
0.8633 High Similarity NPC274717
0.8633 High Similarity NPC38664
0.8621 High Similarity NPC262189
0.8611 High Similarity NPC474687
0.8609 High Similarity NPC473621
0.8601 High Similarity NPC238243
0.86 High Similarity NPC295573
0.86 High Similarity NPC470208
0.8592 High Similarity NPC215037
0.8592 High Similarity NPC77196
0.8592 High Similarity NPC85435
0.859 High Similarity NPC48880
0.8582 High Similarity NPC236014
0.8582 High Similarity NPC68205
0.8582 High Similarity NPC300875
0.8582 High Similarity NPC150011
0.8582 High Similarity NPC280653
0.8582 High Similarity NPC211413
0.8582 High Similarity NPC293203
0.8582 High Similarity NPC206224
0.8582 High Similarity NPC129106
0.8582 High Similarity NPC164574
0.8582 High Similarity NPC118114
0.8582 High Similarity NPC268917
0.8582 High Similarity NPC228369
0.8582 High Similarity NPC129784
0.8582 High Similarity NPC196765
0.8582 High Similarity NPC476166
0.8582 High Similarity NPC118683
0.8582 High Similarity NPC244888
0.8582 High Similarity NPC12875
0.8582 High Similarity NPC164804
0.8582 High Similarity NPC207892
0.8582 High Similarity NPC17343
0.8581 High Similarity NPC161700
0.8581 High Similarity NPC277867
0.8581 High Similarity NPC271076
0.8571 High Similarity NPC93962
0.8571 High Similarity NPC168789
0.8562 High Similarity NPC273932
0.8562 High Similarity NPC257095
0.8562 High Similarity NPC89686
0.8553 High Similarity NPC21902
0.8551 High Similarity NPC207179
0.8551 High Similarity NPC167571
0.8551 High Similarity NPC278552
0.8543 High Similarity NPC472710
0.8543 High Similarity NPC472709
0.8542 High Similarity NPC3049
0.8542 High Similarity NPC40664
0.8542 High Similarity NPC141717
0.8542 High Similarity NPC138350
0.8542 High Similarity NPC165482
0.8542 High Similarity NPC3293
0.8542 High Similarity NPC197723
0.8533 High Similarity NPC281549
0.8533 High Similarity NPC270751
0.8531 High Similarity NPC223008
0.8531 High Similarity NPC225696
0.8531 High Similarity NPC198154
0.8531 High Similarity NPC473107
0.8531 High Similarity NPC115335
0.8531 High Similarity NPC97834
0.8531 High Similarity NPC296915
0.8523 High Similarity NPC190714
0.8523 High Similarity NPC99515
0.8523 High Similarity NPC14468
0.8523 High Similarity NPC260397
0.8521 High Similarity NPC303422
0.8521 High Similarity NPC13005
0.8521 High Similarity NPC165686
0.8521 High Similarity NPC26080
0.8521 High Similarity NPC85799
0.8514 High Similarity NPC472155
0.8514 High Similarity NPC473108
0.8514 High Similarity NPC304894
0.8514 High Similarity NPC15659
0.8511 High Similarity NPC470225
0.8511 High Similarity NPC27187
0.85 High Similarity NPC222572
0.85 High Similarity NPC87224
0.8497 Intermediate Similarity NPC78809
0.8493 Intermediate Similarity NPC193920
0.8493 Intermediate Similarity NPC174787
0.8493 Intermediate Similarity NPC213607
0.8493 Intermediate Similarity NPC182509
0.8493 Intermediate Similarity NPC22317
0.8491 Intermediate Similarity NPC9309
0.8489 Intermediate Similarity NPC276212
0.8489 Intermediate Similarity NPC26879
0.8489 Intermediate Similarity NPC230479
0.8489 Intermediate Similarity NPC283049
0.8489 Intermediate Similarity NPC50315

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC102280 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
0.8777 High Similarity NPD4907 Clinical (unspecified phase)
0.8633 High Similarity NPD4908 Phase 1
0.8442 Intermediate Similarity NPD8455 Phase 2
0.8264 Intermediate Similarity NPD1612 Clinical (unspecified phase)
0.8264 Intermediate Similarity NPD1613 Approved
0.8261 Intermediate Similarity NPD1610 Phase 2
0.8 Intermediate Similarity NPD1091 Approved
0.7986 Intermediate Similarity NPD1529 Clinical (unspecified phase)
0.7939 Intermediate Similarity NPD7804 Clinical (unspecified phase)
0.7937 Intermediate Similarity NPD4381 Clinical (unspecified phase)
0.7917 Intermediate Similarity NPD1530 Clinical (unspecified phase)
0.7842 Intermediate Similarity NPD1548 Phase 1
0.7829 Intermediate Similarity NPD6674 Discontinued
0.7808 Intermediate Similarity NPD3027 Phase 3
0.7793 Intermediate Similarity NPD2861 Phase 2
0.7785 Intermediate Similarity NPD4380 Phase 2
0.7784 Intermediate Similarity NPD7074 Phase 3
0.7771 Intermediate Similarity NPD7228 Approved
0.7733 Intermediate Similarity NPD7097 Phase 1
0.7718 Intermediate Similarity NPD5124 Phase 1
0.7718 Intermediate Similarity NPD5123 Clinical (unspecified phase)
0.7706 Intermediate Similarity NPD8313 Approved
0.7706 Intermediate Similarity NPD8312 Approved
0.7702 Intermediate Similarity NPD8443 Clinical (unspecified phase)
0.7687 Intermediate Similarity NPD4625 Phase 3
0.7683 Intermediate Similarity NPD6959 Discontinued
0.7677 Intermediate Similarity NPD5058 Phase 3
0.7658 Intermediate Similarity NPD1653 Approved
0.7654 Intermediate Similarity NPD4868 Clinical (unspecified phase)
0.7651 Intermediate Similarity NPD6167 Clinical (unspecified phase)
0.7651 Intermediate Similarity NPD6166 Phase 2
0.7651 Intermediate Similarity NPD6168 Clinical (unspecified phase)
0.7635 Intermediate Similarity NPD6410 Clinical (unspecified phase)
0.7633 Intermediate Similarity NPD7993 Clinical (unspecified phase)
0.7628 Intermediate Similarity NPD7212 Phase 2
0.7628 Intermediate Similarity NPD7213 Phase 3
0.7619 Intermediate Similarity NPD7054 Approved
0.7597 Intermediate Similarity NPD5698 Clinical (unspecified phase)
0.7588 Intermediate Similarity NPD6559 Discontinued
0.758 Intermediate Similarity NPD7447 Phase 1
0.7578 Intermediate Similarity NPD37 Approved
0.7576 Intermediate Similarity NPD7199 Phase 2
0.7574 Intermediate Similarity NPD7472 Approved
0.7561 Intermediate Similarity NPD6234 Discontinued
0.7546 Intermediate Similarity NPD4965 Approved
0.7546 Intermediate Similarity NPD4966 Approved
0.7546 Intermediate Similarity NPD7768 Phase 2
0.7546 Intermediate Similarity NPD4967 Phase 2
0.7545 Intermediate Similarity NPD7852 Clinical (unspecified phase)
0.7533 Intermediate Similarity NPD4060 Phase 1
0.753 Intermediate Similarity NPD3787 Discontinued
0.7529 Intermediate Similarity NPD6797 Phase 2
0.7517 Intermediate Similarity NPD4749 Approved
0.75 Intermediate Similarity NPD4536 Approved
0.75 Intermediate Similarity NPD4538 Approved
0.75 Intermediate Similarity NPD7075 Discontinued
0.75 Intermediate Similarity NPD4537 Clinical (unspecified phase)
0.7485 Intermediate Similarity NPD7251 Discontinued
0.7466 Intermediate Similarity NPD8651 Approved
0.7451 Intermediate Similarity NPD5960 Phase 3
0.7451 Intermediate Similarity NPD5588 Approved
0.7442 Intermediate Similarity NPD7808 Phase 3
0.7423 Intermediate Similarity NPD2393 Clinical (unspecified phase)
0.7412 Intermediate Similarity NPD5844 Phase 1
0.7407 Intermediate Similarity NPD7411 Suspended
0.7384 Intermediate Similarity NPD7240 Approved
0.7381 Intermediate Similarity NPD7184 Clinical (unspecified phase)
0.7372 Intermediate Similarity NPD1652 Phase 2
0.7358 Intermediate Similarity NPD7004 Clinical (unspecified phase)
0.7355 Intermediate Similarity NPD7266 Discontinued
0.7353 Intermediate Similarity NPD3818 Discontinued
0.7317 Intermediate Similarity NPD7096 Clinical (unspecified phase)
0.7301 Intermediate Similarity NPD7615 Clinical (unspecified phase)
0.7285 Intermediate Similarity NPD6859 Clinical (unspecified phase)
0.7285 Intermediate Similarity NPD6798 Discontinued
0.7256 Intermediate Similarity NPD6801 Discontinued
0.7256 Intermediate Similarity NPD1934 Approved
0.7254 Intermediate Similarity NPD7157 Approved
0.7251 Intermediate Similarity NPD3751 Discontinued
0.725 Intermediate Similarity NPD7410 Clinical (unspecified phase)
0.725 Intermediate Similarity NPD4378 Clinical (unspecified phase)
0.7244 Intermediate Similarity NPD1550 Clinical (unspecified phase)
0.7244 Intermediate Similarity NPD1552 Clinical (unspecified phase)
0.7241 Intermediate Similarity NPD6516 Phase 2
0.7241 Intermediate Similarity NPD5846 Approved
0.7241 Intermediate Similarity NPD4338 Clinical (unspecified phase)
0.7241 Intermediate Similarity NPD5126 Approved
0.7241 Intermediate Similarity NPD5125 Phase 3
0.7215 Intermediate Similarity NPD3750 Approved
0.7215 Intermediate Similarity NPD7466 Approved
0.7197 Intermediate Similarity NPD1549 Phase 2
0.7163 Intermediate Similarity NPD7843 Approved
0.716 Intermediate Similarity NPD5403 Approved
0.7143 Intermediate Similarity NPD422 Phase 1
0.7143 Intermediate Similarity NPD6355 Discontinued
0.7133 Intermediate Similarity NPD6917 Clinical (unspecified phase)
0.7124 Intermediate Similarity NPD6233 Phase 2
0.7122 Intermediate Similarity NPD2684 Approved
0.7111 Intermediate Similarity NPD7879 Clinical (unspecified phase)
0.7108 Intermediate Similarity NPD7819 Suspended
0.7101 Intermediate Similarity NPD5494 Approved
0.7089 Intermediate Similarity NPD2424 Discontinued
0.7073 Intermediate Similarity NPD5808 Clinical (unspecified phase)
0.7073 Intermediate Similarity NPD7458 Discontinued
0.7066 Intermediate Similarity NPD5402 Approved
0.7062 Intermediate Similarity NPD8053 Approved
0.7062 Intermediate Similarity NPD8054 Approved
0.7051 Intermediate Similarity NPD7119 Phase 2
0.705 Intermediate Similarity NPD290 Approved
0.7047 Intermediate Similarity NPD3600 Clinical (unspecified phase)
0.7045 Intermediate Similarity NPD7549 Discontinued
0.7044 Intermediate Similarity NPD7421 Clinical (unspecified phase)
0.7037 Intermediate Similarity NPD5401 Approved
0.7032 Intermediate Similarity NPD5735 Approved
0.7025 Intermediate Similarity NPD5763 Approved
0.7025 Intermediate Similarity NPD5762 Approved
0.7018 Intermediate Similarity NPD6232 Discontinued
0.7018 Intermediate Similarity NPD7229 Phase 3
0.7006 Intermediate Similarity NPD1465 Phase 2
0.7005 Intermediate Similarity NPD7680 Approved
0.7 Intermediate Similarity NPD4535 Phase 3
0.7 Intermediate Similarity NPD8397 Clinical (unspecified phase)
0.7 Intermediate Similarity NPD3892 Phase 2
0.7 Intermediate Similarity NPD4628 Phase 3
0.7 Intermediate Similarity NPD6398 Clinical (unspecified phase)
0.6994 Remote Similarity NPD7473 Discontinued
0.6982 Remote Similarity NPD7975 Clinical (unspecified phase)
0.6982 Remote Similarity NPD3749 Approved
0.6975 Remote Similarity NPD7040 Clinical (unspecified phase)
0.6975 Remote Similarity NPD7041 Phase 2
0.6974 Remote Similarity NPD3018 Phase 2
0.6973 Remote Similarity NPD7237 Clinical (unspecified phase)
0.697 Remote Similarity NPD8158 Clinical (unspecified phase)
0.6968 Remote Similarity NPD5837 Clinical (unspecified phase)
0.6962 Remote Similarity NPD6099 Approved
0.6962 Remote Similarity NPD6100 Approved
0.6943 Remote Similarity NPD4978 Clinical (unspecified phase)
0.6933 Remote Similarity NPD6582 Phase 2
0.6933 Remote Similarity NPD7446 Clinical (unspecified phase)
0.6933 Remote Similarity NPD6583 Phase 3
0.6933 Remote Similarity NPD4160 Clinical (unspecified phase)
0.6927 Remote Similarity NPD7782 Clinical (unspecified phase)
0.6927 Remote Similarity NPD8055 Clinical (unspecified phase)
0.6927 Remote Similarity NPD7783 Phase 2
0.6918 Remote Similarity NPD6003 Clinical (unspecified phase)
0.6918 Remote Similarity NPD6005 Phase 3
0.6918 Remote Similarity NPD6006 Clinical (unspecified phase)
0.6918 Remote Similarity NPD6004 Phase 3
0.6918 Remote Similarity NPD6002 Phase 3
0.6914 Remote Similarity NPD6666 Approved
0.6914 Remote Similarity NPD6667 Approved
0.6911 Remote Similarity NPD8151 Discontinued
0.6908 Remote Similarity NPD6584 Phase 3
0.6905 Remote Similarity NPD2801 Approved
0.6899 Remote Similarity NPD1510 Phase 2
0.6899 Remote Similarity NPD7033 Discontinued
0.6899 Remote Similarity NPD3748 Approved
0.6899 Remote Similarity NPD4108 Discontinued
0.6897 Remote Similarity NPD6671 Approved
0.6886 Remote Similarity NPD6072 Discontinued
0.6883 Remote Similarity NPD7095 Approved
0.6875 Remote Similarity NPD7037 Approved
0.6871 Remote Similarity NPD6799 Approved
0.6871 Remote Similarity NPD1511 Approved
0.6864 Remote Similarity NPD3817 Phase 2
0.6859 Remote Similarity NPD3619 Clinical (unspecified phase)
0.6859 Remote Similarity NPD4140 Approved
0.6859 Remote Similarity NPD3620 Phase 2
0.6857 Remote Similarity NPD968 Approved
0.6855 Remote Similarity NPD2796 Approved
0.6845 Remote Similarity NPD6777 Approved
0.6845 Remote Similarity NPD6779 Approved
0.6845 Remote Similarity NPD6776 Approved
0.6845 Remote Similarity NPD6780 Approved
0.6845 Remote Similarity NPD6778 Approved
0.6845 Remote Similarity NPD6782 Approved
0.6845 Remote Similarity NPD6781 Approved
0.6842 Remote Similarity NPD2797 Approved
0.6832 Remote Similarity NPD5062 Approved
0.6832 Remote Similarity NPD5061 Approved
0.6826 Remote Similarity NPD6599 Discontinued
0.6821 Remote Similarity NPD3685 Discontinued
0.6821 Remote Similarity NPD2982 Phase 2
0.6821 Remote Similarity NPD2983 Phase 2
0.6818 Remote Similarity NPD8156 Discontinued
0.6815 Remote Similarity NPD4340 Discontinued
0.6806 Remote Similarity NPD5535 Approved
0.68 Remote Similarity NPD3705 Approved
0.679 Remote Similarity NPD7003 Approved
0.6788 Remote Similarity NPD1512 Approved
0.6776 Remote Similarity NPD3225 Approved
0.6772 Remote Similarity NPD6823 Phase 2
0.6768 Remote Similarity NPD6143 Clinical (unspecified phase)
0.6763 Remote Similarity NPD8127 Discontinued
0.6761 Remote Similarity NPD8251 Approved
0.6761 Remote Similarity NPD8099 Discontinued
0.6761 Remote Similarity NPD8252 Approved
0.676 Remote Similarity NPD8453 Clinical (unspecified phase)
0.6759 Remote Similarity NPD5283 Phase 1
0.6755 Remote Similarity NPD2981 Phase 2

Structure

External Identifiers

PubChem CID   73353883
ChEMBL   CHEMBL2431896
ZINC  

Physicochemical Properties

Molecular Weight:  544.14
ALogP:  -3.8841
MLogP:  3.66
XLogP:  1.673
# Rotatable Bonds:  9
Polar Surface Area:  169.3
# H-Bond Aceptor:  2
# H-Bond Donor:  7
# Rings:  7
# Heavy Atoms:  40

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Structure MOL file  
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Biological Activities  
Similar NPs/Drugs