Natural Product: NPC224543

Natural Product ID:  NPC224543
Common Name:   (+)-Lomatin
IUPAC Name:   (9R)-9-hydroxy-8,8-dimethyl-9,10-dihydropyrano[2,3-h]chromen-2-one
Synonyms:   (+)-Lomatin; Lomatin
Molecular Formula:   C14H14O4
Standard InCHIKey:  UJSHBYQGQRPVNO-LLVKDONJSA-N
Standard InCHI:  InChI=1S/C14H14O4/c1-14(2)11(15)7-9-10(18-14)5-3-8-4-6-12(16)17-13(8)9/h3-6,11,15H,7H2,1-2H3/t11-/m1/s1
Canonical SMILES:  O=c1ccc2c(o1)c1C[C@@H](O)C(Oc1cc2)(C)C
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
NPO14809 Talaromyces avellaneus Species Trichocomaceae Eukaryota UNPD*
NPO32915 prionosciadium watsoni Species Apiaceae Eukaryota PMID[12088423]
NPO2741 Ribes sanguineum Species Grossulariaceae Eukaryota UNPD*
NPO1821 Kopsia albiflora Species Apocynaceae Eukaryota UNPD*
NPO14108 Nardostachys jatamansi Species Caprifoliaceae Eukaryota TCM_Taiwan*
NPO5497 Stachys chinensis Species Lamiaceae Eukaryota UNPD*
NPO16614 Zanthoxylum spinosum Species Rutaceae Eukaryota UNPD*
NPO6444 Humulus scandens Species Cannabaceae Eukaryota UNPD*
NPO29700 Peucedani radix NA NA NA TCMSP*
NPO2921 Angelica acutiloba Species Apiaceae Eukaryota TM-MC*
NPO11438 Angelica gigas Species Apiaceae Eukaryota TM-MC*
NPO15462 Angelica sinensis Species Apiaceae Eukaryota TM-MC*
NPO14108 Nardostachys jatamansi Species Caprifoliaceae Eukaryota TM-MC*
NPO14108 Nardostachys jatamansi Species Caprifoliaceae Eukaryota TCMID*
NPO6800 Libanotis buchtormensis Species Apiaceae Eukaryota TCMID*

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT965 Organism Amaranthus hypochondriacus Amaranthus hypochondriacus IC50 = 344000 nM 12088423
NPT117 Organism Echinochloa crus-galli Echinochloa crus-galli IC50 = 296000 nM 12088423
NPT48 Individual Protein Lysine-specific demethylase 4D-like Homo sapiens Potency = 28183.8 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency = 25929 nM PubChem BioAssay data set
NPT54 Individual Protein Nonstructural protein 1 Influenza A virus Potency = 4466.8 nM PubChem BioAssay data set
NPT6 Organism Plasmodium falciparum Plasmodium falciparum Potency 10417.9 nM PubChem BioAssay data set
NPT6 Organism Plasmodium falciparum Plasmodium falciparum Potency 11689.1 nM PubChem BioAssay data set
NPT7 Individual Protein Thioredoxin reductase 1, cytoplasmic Rattus norvegicus Potency 22387.2 nM PubChem BioAssay data set
NPT11 Individual Protein Guanine nucleotide-binding protein G(s), subunit alpha Homo sapiens Potency 11220.2 nM PubChem BioAssay data set

  Similar Natural Products in NPASS

Similarity level is defined by Tanimoto coefficient (Tc) between two molecules. Tc lies between [0, 1] where '1' indicates the highest similarity. What is Tanimoto coefficient

●  The left chart: Distribution of similarity level between NPC224543 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 NPC188380
1.0 High Similarity NPC78746
0.9923 High Similarity NPC294456
0.9923 High Similarity NPC153818
0.9923 High Similarity NPC212124
0.9923 High Similarity NPC281014
0.9923 High Similarity NPC184861
0.9923 High Similarity NPC232246
0.9923 High Similarity NPC225106
0.9773 High Similarity NPC312881
0.9699 High Similarity NPC152771
0.9699 High Similarity NPC195357
0.9699 High Similarity NPC287286
0.9697 High Similarity NPC279573
0.9692 High Similarity NPC62366
0.9621 High Similarity NPC155963
0.9618 High Similarity NPC472525
0.9618 High Similarity NPC33986
0.9549 High Similarity NPC211110
0.9549 High Similarity NPC151946
0.9545 High Similarity NPC38099
0.9545 High Similarity NPC26954
0.9542 High Similarity NPC224475
0.9542 High Similarity NPC180716
0.9542 High Similarity NPC253574
0.9542 High Similarity NPC50896
0.9542 High Similarity NPC213173
0.9542 High Similarity NPC204353
0.9542 High Similarity NPC98179
0.9542 High Similarity NPC326600
0.9466 High Similarity NPC471910
0.9466 High Similarity NPC133956
0.9466 High Similarity NPC207002
0.9466 High Similarity NPC296624
0.9466 High Similarity NPC318400
0.9466 High Similarity NPC167111
0.9416 High Similarity NPC85624
0.9416 High Similarity NPC469701
0.9394 High Similarity NPC47163
0.9394 High Similarity NPC198381
0.9394 High Similarity NPC195343
0.9394 High Similarity NPC74655
0.9394 High Similarity NPC319859
0.9394 High Similarity NPC267412
0.9394 High Similarity NPC84894
0.9394 High Similarity NPC127888
0.9394 High Similarity NPC164269
0.9394 High Similarity NPC166672
0.9394 High Similarity NPC18804
0.9394 High Similarity NPC287182
0.9394 High Similarity NPC100986
0.9394 High Similarity NPC260265
0.9389 High Similarity NPC194277
0.9323 High Similarity NPC471625
0.9323 High Similarity NPC281241
0.9323 High Similarity NPC472424
0.9323 High Similarity NPC86892
0.9323 High Similarity NPC471909
0.9318 High Similarity NPC31849
0.9313 High Similarity NPC29734
0.9281 High Similarity NPC471764
0.9281 High Similarity NPC87950
0.9281 High Similarity NPC296377
0.9254 High Similarity NPC160727
0.9254 High Similarity NPC177281
0.9254 High Similarity NPC476455
0.9254 High Similarity NPC55615
0.9254 High Similarity NPC283019
0.9254 High Similarity NPC471630
0.9254 High Similarity NPC128529
0.9254 High Similarity NPC149320
0.9237 High Similarity NPC113098
0.9231 High Similarity NPC185066
0.9214 High Similarity NPC169510
0.9203 High Similarity NPC471824
0.9173 High Similarity NPC163557
0.9167 High Similarity NPC272650
0.9167 High Similarity NPC267336
0.916 High Similarity NPC168710
0.9104 High Similarity NPC55149
0.9104 High Similarity NPC307412
0.9098 High Similarity NPC14248
0.9091 High Similarity NPC80170
0.9084 High Similarity NPC199204
0.9077 High Similarity NPC471826
0.907 High Similarity NPC111347
0.9065 High Similarity NPC471763
0.9037 High Similarity NPC469675
0.903 High Similarity NPC7526
0.903 High Similarity NPC469449
0.903 High Similarity NPC222036
0.8971 High Similarity NPC103409
0.8951 High Similarity NPC103116
0.8931 High Similarity NPC188327
0.8931 High Similarity NPC234109
0.8905 High Similarity NPC471069
0.8905 High Similarity NPC471068
0.8889 High Similarity NPC469965
0.8889 High Similarity NPC141822
0.8889 High Similarity NPC1220
0.8889 High Similarity NPC291551
0.8889 High Similarity NPC241165
0.8889 High Similarity NPC142563
0.8889 High Similarity NPC205797
0.8864 High Similarity NPC258567
0.8864 High Similarity NPC121740
0.8864 High Similarity NPC224774
0.8864 High Similarity NPC473993
0.8857 High Similarity NPC183646
0.8857 High Similarity NPC119640
0.8855 High Similarity NPC244495
0.8855 High Similarity NPC93219
0.8849 High Similarity NPC476442
0.8849 High Similarity NPC215512
0.8849 High Similarity NPC279851
0.8849 High Similarity NPC472520
0.8849 High Similarity NPC300611
0.8846 High Similarity NPC173350
0.8846 High Similarity NPC290605
0.8846 High Similarity NPC472518
0.8846 High Similarity NPC154176
0.8841 High Similarity NPC35501
0.8841 High Similarity NPC270256
0.8841 High Similarity NPC471070
0.8841 High Similarity NPC278600
0.8841 High Similarity NPC47040
0.8841 High Similarity NPC471072
0.8841 High Similarity NPC144512
0.8841 High Similarity NPC137262
0.8841 High Similarity NPC471071
0.8841 High Similarity NPC37428
0.8832 High Similarity NPC283331
0.8828 High Similarity NPC470264
0.8824 High Similarity NPC131950
0.8803 High Similarity NPC205361
0.8797 High Similarity NPC469453
0.8794 High Similarity NPC476457
0.8779 High Similarity NPC201667
0.8779 High Similarity NPC73413
0.8769 High Similarity NPC248429
0.8769 High Similarity NPC13007
0.8769 High Similarity NPC257188
0.8769 High Similarity NPC96286
0.8768 High Similarity NPC131198
0.8741 High Similarity NPC476347
0.8741 High Similarity NPC15577
0.8741 High Similarity NPC103799
0.8732 High Similarity NPC226722
0.8723 High Similarity NPC236419
0.8722 High Similarity NPC243688
0.8714 High Similarity NPC138149
0.8712 High Similarity NPC471827
0.8712 High Similarity NPC471828
0.8702 High Similarity NPC109675
0.8702 High Similarity NPC273772
0.8696 High Similarity NPC167517
0.8692 High Similarity NPC144418
0.8686 High Similarity NPC309953
0.8681 High Similarity NPC187398
0.8681 High Similarity NPC476348
0.8676 High Similarity NPC123954
0.8676 High Similarity NPC19157
0.8667 High Similarity NPC32463
0.8657 High Similarity NPC60704
0.8657 High Similarity NPC472519
0.8657 High Similarity NPC293642
0.8657 High Similarity NPC139595
0.8652 High Similarity NPC20631
0.8652 High Similarity NPC93640
0.8639 High Similarity NPC256141
0.8636 High Similarity NPC27671
0.8636 High Similarity NPC291899
0.8615 High Similarity NPC163200
0.8613 High Similarity NPC92805
0.8613 High Similarity NPC2363
0.8613 High Similarity NPC469955
0.8613 High Similarity NPC469952
0.8605 High Similarity NPC281356
0.8605 High Similarity NPC298796
0.8603 High Similarity NPC250727
0.8601 High Similarity NPC295696
0.8601 High Similarity NPC475719
0.8601 High Similarity NPC106126
0.8601 High Similarity NPC108994
0.8601 High Similarity NPC101255
0.8601 High Similarity NPC43716
0.8592 High Similarity NPC138212
0.8592 High Similarity NPC229916
0.8571 High Similarity NPC207179
0.8571 High Similarity NPC232692
0.8571 High Similarity NPC167571
0.8571 High Similarity NPC13067
0.8571 High Similarity NPC168259
0.8571 High Similarity NPC43500
0.8571 High Similarity NPC278552
0.8571 High Similarity NPC202594
0.8571 High Similarity NPC164148
0.8562 High Similarity NPC205727
0.8562 High Similarity NPC120426
0.8562 High Similarity NPC294522

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC224543 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
0.8889 High Similarity NPD5124 Phase 1
0.8889 High Similarity NPD5123 Clinical (unspecified phase)
0.8849 High Similarity NPD1652 Phase 2
0.855 High Similarity NPD422 Phase 1
0.8367 Intermediate Similarity NPD1653 Approved
0.8273 Intermediate Similarity NPD1612 Clinical (unspecified phase)
0.8273 Intermediate Similarity NPD1613 Approved
0.8212 Intermediate Similarity NPD7096 Clinical (unspecified phase)
0.8052 Intermediate Similarity NPD7075 Discontinued
0.8026 Intermediate Similarity NPD6801 Discontinued
0.8013 Intermediate Similarity NPD4380 Phase 2
0.8 Intermediate Similarity NPD2424 Discontinued
0.8 Intermediate Similarity NPD1610 Phase 2
0.8 Intermediate Similarity NPD4907 Clinical (unspecified phase)
0.7986 Intermediate Similarity NPD1529 Clinical (unspecified phase)
0.797 Intermediate Similarity NPD1548 Phase 1
0.7914 Intermediate Similarity NPD1530 Clinical (unspecified phase)
0.7872 Intermediate Similarity NPD6859 Clinical (unspecified phase)
0.7868 Intermediate Similarity NPD1091 Approved
0.7857 Intermediate Similarity NPD4908 Phase 1
0.7857 Intermediate Similarity NPD1008 Clinical (unspecified phase)
0.7826 Intermediate Similarity NPD5844 Phase 1
0.7821 Intermediate Similarity NPD4381 Clinical (unspecified phase)
0.78 Intermediate Similarity NPD5401 Approved
0.777 Intermediate Similarity NPD3750 Approved
0.777 Intermediate Similarity NPD6398 Clinical (unspecified phase)
0.7756 Intermediate Similarity NPD4868 Clinical (unspecified phase)
0.7755 Intermediate Similarity NPD1549 Phase 2
0.7746 Intermediate Similarity NPD1296 Phase 2
0.7742 Intermediate Similarity NPD7819 Suspended
0.7742 Intermediate Similarity NPD2393 Clinical (unspecified phase)
0.7733 Intermediate Similarity NPD6799 Approved
0.7727 Intermediate Similarity NPD7411 Suspended
0.7698 Intermediate Similarity NPD8651 Approved
0.7697 Intermediate Similarity NPD920 Approved
0.7697 Intermediate Similarity NPD5403 Approved
0.7687 Intermediate Similarity NPD1552 Clinical (unspecified phase)
0.7687 Intermediate Similarity NPD1550 Clinical (unspecified phase)
0.7682 Intermediate Similarity NPD4378 Clinical (unspecified phase)
0.7677 Intermediate Similarity NPD1934 Approved
0.7676 Intermediate Similarity NPD3027 Phase 3
0.7674 Intermediate Similarity NPD290 Approved
0.7671 Intermediate Similarity NPD3748 Approved
0.7651 Intermediate Similarity NPD4628 Phase 3
0.7639 Intermediate Similarity NPD4060 Phase 1
0.7622 Intermediate Similarity NPD6410 Clinical (unspecified phase)
0.7622 Intermediate Similarity NPD6798 Discontinued
0.7619 Intermediate Similarity NPD2796 Approved
0.7613 Intermediate Similarity NPD7615 Clinical (unspecified phase)
0.7607 Intermediate Similarity NPD7804 Clinical (unspecified phase)
0.7603 Intermediate Similarity NPD7097 Phase 1
0.7603 Intermediate Similarity NPD4537 Clinical (unspecified phase)
0.7603 Intermediate Similarity NPD4538 Approved
0.7603 Intermediate Similarity NPD4536 Approved
0.7584 Intermediate Similarity NPD5698 Clinical (unspecified phase)
0.7584 Intermediate Similarity NPD1243 Approved
0.7584 Intermediate Similarity NPD7421 Clinical (unspecified phase)
0.758 Intermediate Similarity NPD2415 Discontinued
0.758 Intermediate Similarity NPD5402 Approved
0.758 Intermediate Similarity NPD3817 Phase 2
0.7576 Intermediate Similarity NPD6559 Discontinued
0.7571 Intermediate Similarity NPD3225 Approved
0.7566 Intermediate Similarity NPD642 Clinical (unspecified phase)
0.7552 Intermediate Similarity NPD4625 Phase 3
0.7551 Intermediate Similarity NPD1510 Phase 2
0.7551 Intermediate Similarity NPD7033 Discontinued
0.755 Intermediate Similarity NPD643 Clinical (unspecified phase)
0.755 Intermediate Similarity NPD5058 Phase 3
0.7548 Intermediate Similarity NPD6599 Discontinued
0.7538 Intermediate Similarity NPD1358 Approved
0.7532 Intermediate Similarity NPD7768 Phase 2
0.7519 Intermediate Similarity NPD9697 Approved
0.7518 Intermediate Similarity NPD2797 Approved
0.7516 Intermediate Similarity NPD8455 Phase 2
0.75 Intermediate Similarity NPD4749 Approved
0.75 Intermediate Similarity NPD1551 Phase 2
0.7481 Intermediate Similarity NPD2684 Approved
0.7466 Intermediate Similarity NPD6355 Discontinued
0.7466 Intermediate Similarity NPD4340 Discontinued
0.7451 Intermediate Similarity NPD7410 Clinical (unspecified phase)
0.745 Intermediate Similarity NPD5763 Approved
0.745 Intermediate Similarity NPD5762 Approved
0.7448 Intermediate Similarity NPD6233 Phase 2
0.7438 Intermediate Similarity NPD919 Approved
0.7432 Intermediate Similarity NPD5588 Approved
0.7432 Intermediate Similarity NPD4308 Phase 3
0.7432 Intermediate Similarity NPD5960 Phase 3
0.7425 Intermediate Similarity NPD7549 Discontinued
0.7417 Intermediate Similarity NPD1878 Clinical (unspecified phase)
0.741 Intermediate Similarity NPD3496 Discontinued
0.7405 Intermediate Similarity NPD1465 Phase 2
0.7403 Intermediate Similarity NPD7314 Clinical (unspecified phase)
0.74 Intermediate Similarity NPD970 Clinical (unspecified phase)
0.7391 Intermediate Similarity NPD5691 Approved
0.7388 Intermediate Similarity NPD5535 Approved
0.7388 Intermediate Similarity NPD7843 Approved
0.7386 Intermediate Similarity NPD1511 Approved
0.7379 Intermediate Similarity NPD3268 Approved
0.7379 Intermediate Similarity NPD2313 Discontinued
0.7358 Intermediate Similarity NPD8443 Clinical (unspecified phase)
0.7353 Intermediate Similarity NPD7157 Approved
0.7342 Intermediate Similarity NPD4433 Discontinued
0.7338 Intermediate Similarity NPD4626 Approved
0.7333 Intermediate Similarity NPD6005 Phase 3
0.7333 Intermediate Similarity NPD6006 Clinical (unspecified phase)
0.7333 Intermediate Similarity NPD6003 Clinical (unspecified phase)
0.7333 Intermediate Similarity NPD3818 Discontinued
0.7333 Intermediate Similarity NPD6002 Phase 3
0.7333 Intermediate Similarity NPD6004 Phase 3
0.7333 Intermediate Similarity NPD7266 Discontinued
0.7317 Intermediate Similarity NPD6166 Phase 2
0.7317 Intermediate Similarity NPD7852 Clinical (unspecified phase)
0.7317 Intermediate Similarity NPD6168 Clinical (unspecified phase)
0.7317 Intermediate Similarity NPD6167 Clinical (unspecified phase)
0.731 Intermediate Similarity NPD7095 Approved
0.7305 Intermediate Similarity NPD9717 Approved
0.7305 Intermediate Similarity NPD7993 Clinical (unspecified phase)
0.7296 Intermediate Similarity NPD2801 Approved
0.7292 Intermediate Similarity NPD2861 Phase 2
0.729 Intermediate Similarity NPD1512 Approved
0.7289 Intermediate Similarity NPD7054 Approved
0.7284 Intermediate Similarity NPD5494 Approved
0.7279 Intermediate Similarity NPD4140 Approved
0.7279 Intermediate Similarity NPD4307 Phase 2
0.7279 Intermediate Similarity NPD1240 Approved
0.7273 Intermediate Similarity NPD3266 Approved
0.7273 Intermediate Similarity NPD3267 Approved
0.7267 Intermediate Similarity NPD3749 Approved
0.7267 Intermediate Similarity NPD2935 Discontinued
0.7261 Intermediate Similarity NPD8158 Clinical (unspecified phase)
0.7246 Intermediate Similarity NPD7472 Approved
0.7246 Intermediate Similarity NPD7074 Phase 3
0.7239 Intermediate Similarity NPD7199 Phase 2
0.7237 Intermediate Similarity NPD6674 Discontinued
0.7234 Intermediate Similarity NPD1611 Approved
0.7233 Intermediate Similarity NPD37 Approved
0.723 Intermediate Similarity NPD447 Suspended
0.723 Intermediate Similarity NPD230 Phase 1
0.7219 Intermediate Similarity NPD4338 Clinical (unspecified phase)
0.7214 Intermediate Similarity NPD1778 Approved
0.7208 Intermediate Similarity NPD6667 Approved
0.7208 Intermediate Similarity NPD6666 Approved
0.7205 Intermediate Similarity NPD4967 Phase 2
0.7205 Intermediate Similarity NPD4966 Approved
0.7205 Intermediate Similarity NPD4965 Approved
0.7202 Intermediate Similarity NPD6797 Phase 2
0.72 Intermediate Similarity NPD2799 Discontinued
0.7197 Intermediate Similarity NPD3134 Approved
0.7181 Intermediate Similarity NPD1607 Approved
0.7161 Intermediate Similarity NPD7212 Phase 2
0.7161 Intermediate Similarity NPD7213 Phase 3
0.716 Intermediate Similarity NPD7251 Discontinued
0.7153 Intermediate Similarity NPD987 Approved
0.7153 Intermediate Similarity NPD1203 Approved
0.7152 Intermediate Similarity NPD5808 Clinical (unspecified phase)
0.7143 Intermediate Similarity NPD7985 Registered
0.7134 Intermediate Similarity NPD8127 Discontinued
0.7126 Intermediate Similarity NPD3751 Discontinued
0.7123 Intermediate Similarity NPD6832 Phase 2
0.7118 Intermediate Similarity NPD7808 Phase 3
0.7117 Intermediate Similarity NPD6234 Discontinued
0.7115 Intermediate Similarity NPD7447 Phase 1
0.7115 Intermediate Similarity NPD2532 Approved
0.7115 Intermediate Similarity NPD7004 Clinical (unspecified phase)
0.7115 Intermediate Similarity NPD2533 Approved
0.7115 Intermediate Similarity NPD2534 Approved
0.7105 Intermediate Similarity NPD2346 Discontinued
0.7103 Intermediate Similarity NPD6917 Clinical (unspecified phase)
0.7103 Intermediate Similarity NPD1019 Discontinued
0.7101 Intermediate Similarity NPD6671 Approved
0.7099 Intermediate Similarity NPD3882 Suspended
0.7095 Intermediate Similarity NPD4062 Phase 3
0.7091 Intermediate Similarity NPD7229 Phase 3
0.7091 Intermediate Similarity NPD6232 Discontinued
0.708 Intermediate Similarity NPD1241 Discontinued
0.7078 Intermediate Similarity NPD7982 Clinical (unspecified phase)
0.7078 Intermediate Similarity NPD4535 Phase 3
0.707 Intermediate Similarity NPD1940 Clinical (unspecified phase)
0.7067 Intermediate Similarity NPD6653 Approved
0.7063 Intermediate Similarity NPD1608 Approved
0.7049 Intermediate Similarity NPD7583 Approved
0.7048 Intermediate Similarity NPD7184 Clinical (unspecified phase)
0.7044 Intermediate Similarity NPD3226 Approved
0.7039 Intermediate Similarity NPD6032 Approved
0.7039 Intermediate Similarity NPD6099 Approved
0.7039 Intermediate Similarity NPD6100 Approved
0.7037 Intermediate Similarity NPD4288 Approved
0.7032 Intermediate Similarity NPD6190 Approved
0.703 Intermediate Similarity NPD6959 Discontinued
0.703 Intermediate Similarity NPD1247 Approved
0.7027 Intermediate Similarity NPD1699 Clinical (unspecified phase)
0.7027 Intermediate Similarity NPD1048 Approved
0.7024 Intermediate Similarity NPD7228 Approved
0.7013 Intermediate Similarity NPD2800 Approved
0.7011 Intermediate Similarity NPD7585 Approved
0.7 Intermediate Similarity NPD1933 Approved
0.7 Intermediate Similarity NPD1899 Clinical (unspecified phase)
0.6993 Remote Similarity NPD1547 Clinical (unspecified phase)
0.6993 Remote Similarity NPD2343 Clinical (unspecified phase)
0.6988 Remote Similarity NPD3787 Discontinued

Structure

External Identifiers

PubChem CID   759302
ChEMBL   CHEMBL503137
ZINC  

Physicochemical Properties

Molecular Weight:  246.09
ALogP:  0.2617
MLogP:  2.56
XLogP:  2.093
# Rotatable Bonds:  3
Polar Surface Area:  55.76
# H-Bond Aceptor:  2
# H-Bond Donor:  1
# Rings:  3
# Heavy Atoms:  18

Download Data

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General Info & Identifiers & Properties  
Structure MOL file  
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Biological Activities  
Similar NPs/Drugs