Natural Product: NPC72649

Natural Product ID:  NPC72649
Common Name:   (2R)-Naringenin-5-O-Beta-D-Glucopyranoside
IUPAC Name:   (2R)-7-hydroxy-2-(4-hydroxyphenyl)-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydrochromen-4-one
Synonyms:  
Molecular Formula:   C21H22O10
Standard InCHIKey:  MFQIWHVVFBCURA-KYSZGLPYSA-N
Standard InCHI:  InChI=1S/C21H22O10/c22-8-16-18(26)19(27)20(28)21(31-16)30-15-6-11(24)5-14-17(15)12(25)7-13(29-14)9-1-3-10(23)4-2-9/h1-6,13,16,18-24,26-28H,7-8H2/t13-,16-,18-,19+,20-,21-/m1/s1
Canonical SMILES:  OC[C@H]1O[C@@H](Oc2cc(O)cc3c2C(=O)C[C@@H](O3)c2ccc(cc2)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
NPO6253 Conus pulicarius Species Conidae Eukaryota UNPD*
NPO11256 Pseudowintera colorata Species Winteraceae Eukaryota UNPD*
NPO5384 Ligustrum obtusifolium Species Oleaceae Eukaryota UNPD*
NPO10737 Asteriscus aquaticus Species Asteraceae Eukaryota UNPD*
NPO3736 Scrophularia koelzii Species Scrophulariaceae Eukaryota UNPD*
NPO10393 Ophidiaster ophidianus Species Ophidiasteridae Eukaryota UNPD*
NPO12888 Echinus microtuberculatus Species Echinidae Eukaryota UNPD*
NPO4138 Betula platyphylla Species Betulaceae Eukaryota UNPD*
NPO5008 Hubertia tomentosa Species Asteraceae Eukaryota UNPD*
NPO2608 Solanum andigena Species Solanaceae Eukaryota UNPD*
NPO7709 Spiracantha cornifolia Species Asteraceae Eukaryota UNPD*
NPO14992 Prunus persica Species Rosaceae Eukaryota TCMID*
NPO9672 Lotus ucrainicus Species Fabaceae Eukaryota UNPD*
NPO4080 Salix purpurea Species Salicaceae Eukaryota TCMID*
NPO12436 Quercus imbricaria Species Fagaceae Eukaryota UNPD*
NPO26705 Rhodiola kirilowii Species Crassulaceae Eukaryota TCMID*
NPO10900 Cinnamomum subavenium Species Lauraceae Eukaryota Leaves PMID[23025417]
NPO28245 Strychnos nux-vomica Species Loganiaceae Eukaryota TCMID*
NPO9305 Iotrochota purpurea Species Iotrochotidae Eukaryota UNPD*
NPO22230 Rhodiola crenulata Species Crassulaceae Eukaryota TCMID*
NPO25870 Vaccinium vitis-idaea Species Ericaceae Eukaryota TCMID*
NPO10900 Cinnamomum subavenium Species Lauraceae Eukaryota UNPD*
NPO20291 Phyllanthus oligospermus Species Phyllanthaceae Eukaryota UNPD*
NPO12188 Datisca glomerata Species Datiscaceae Eukaryota UNPD*
NPO7045 Viviparus japonicus Species Viviparidae Eukaryota UNPD*
NPO4493 Polygonum flaccidum Species Polygonaceae Eukaryota UNPD*
NPO9509 Charpentiera obovata Species Amaranthaceae Eukaryota UNPD*
NPO761 Fagus fusca Species Fagaceae Eukaryota UNPD*
NPO2298 Streptomyces platensis Species Streptomycetaceae Bacteria UNPD*
NPO8477 Myristica cagayanensis Species Myristicaceae Eukaryota UNPD*
NPO15252 Clathria prolifera Species Microcionidae Eukaryota UNPD*
NPO1182 Croton montevidensis Species Euphorbiaceae Eukaryota UNPD*
NPO12669 Cassine papillosa Species Celastraceae Eukaryota UNPD*
NPO11553 Phebalium dentatum Species Rutaceae Eukaryota UNPD*
NPO9922 Myelobia smerintha Species Crambidae Eukaryota UNPD*
NPO8035 Tylophora tanakae Species Apocynaceae Eukaryota UNPD*
NPO12544 Dioscorea olfersiana Species Dioscoreaceae Eukaryota UNPD*
NPO5823 Helichrysum auriceps Species Asteraceae Eukaryota UNPD*
NPO3378 Alstonia undulifolia Species Apocynaceae Eukaryota UNPD*
NPO11811 Capparis ovata Species Capparaceae Eukaryota UNPD*
NPO11699 Ecballium elaterium Species Cucurbitaceae Eukaryota UNPD*
NPO12308 Metridium senile Species Metridiidae Eukaryota UNPD*

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT2 Others Unspecified IC50 = 39800 nM 23025417

  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 NPC72649 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 NPC39351
1.0 High Similarity NPC169248
1.0 High Similarity NPC97052
1.0 High Similarity NPC26195
0.9932 High Similarity NPC206378
0.9932 High Similarity NPC170475
0.9864 High Similarity NPC121001
0.9864 High Similarity NPC259182
0.98 High Similarity NPC308265
0.9797 High Similarity NPC106625
0.9797 High Similarity NPC29763
0.9797 High Similarity NPC83283
0.9797 High Similarity NPC39360
0.9797 High Similarity NPC210003
0.9797 High Similarity NPC143851
0.9735 High Similarity NPC472320
0.9735 High Similarity NPC271479
0.9735 High Similarity NPC200708
0.9735 High Similarity NPC97285
0.9735 High Similarity NPC271270
0.9735 High Similarity NPC246469
0.9735 High Similarity NPC142860
0.9735 High Similarity NPC153342
0.9733 High Similarity NPC156457
0.9733 High Similarity NPC161749
0.9733 High Similarity NPC197896
0.9733 High Similarity NPC258035
0.9733 High Similarity NPC473512
0.9733 High Similarity NPC129827
0.9733 High Similarity NPC65003
0.9733 High Similarity NPC44931
0.9733 High Similarity NPC313163
0.9732 High Similarity NPC99233
0.9732 High Similarity NPC95090
0.9732 High Similarity NPC27408
0.973 High Similarity NPC259767
0.973 High Similarity NPC88484
0.9671 High Similarity NPC47923
0.9671 High Similarity NPC303913
0.9669 High Similarity NPC22062
0.9669 High Similarity NPC73511
0.9669 High Similarity NPC138811
0.9669 High Similarity NPC473634
0.9667 High Similarity NPC127406
0.9667 High Similarity NPC307938
0.9667 High Similarity NPC203500
0.9667 High Similarity NPC323593
0.9608 High Similarity NPC44947
0.9608 High Similarity NPC190450
0.9608 High Similarity NPC259834
0.9608 High Similarity NPC472876
0.9605 High Similarity NPC470405
0.9605 High Similarity NPC471079
0.9605 High Similarity NPC187379
0.9605 High Similarity NPC473623
0.9605 High Similarity NPC304741
0.9605 High Similarity NPC136761
0.9603 High Similarity NPC54802
0.9603 High Similarity NPC135391
0.9603 High Similarity NPC78263
0.9603 High Similarity NPC197304
0.9603 High Similarity NPC122809
0.9603 High Similarity NPC108831
0.9603 High Similarity NPC23817
0.9603 High Similarity NPC133671
0.9603 High Similarity NPC60966
0.9603 High Similarity NPC6985
0.9603 High Similarity NPC182634
0.9603 High Similarity NPC77672
0.9603 High Similarity NPC43638
0.9545 High Similarity NPC124155
0.9545 High Similarity NPC257566
0.9545 High Similarity NPC29830
0.9542 High Similarity NPC476215
0.9542 High Similarity NPC249281
0.9542 High Similarity NPC101636
0.9542 High Similarity NPC116458
0.9542 High Similarity NPC246943
0.9542 High Similarity NPC253788
0.9542 High Similarity NPC139320
0.9542 High Similarity NPC135846
0.9542 High Similarity NPC173582
0.9542 High Similarity NPC297987
0.9542 High Similarity NPC276377
0.9542 High Similarity NPC163242
0.9542 High Similarity NPC181465
0.9542 High Similarity NPC215710
0.9542 High Similarity NPC473438
0.9542 High Similarity NPC170052
0.9542 High Similarity NPC64305
0.9542 High Similarity NPC265885
0.9539 High Similarity NPC472459
0.9539 High Similarity NPC111929
0.9539 High Similarity NPC320283
0.9539 High Similarity NPC41121
0.9536 High Similarity NPC473657
0.9536 High Similarity NPC261866
0.9536 High Similarity NPC149368
0.9536 High Similarity NPC265480
0.9536 High Similarity NPC295613
0.9536 High Similarity NPC45165
0.9481 High Similarity NPC475382
0.9481 High Similarity NPC240306
0.9481 High Similarity NPC298171
0.9481 High Similarity NPC131745
0.9463 High Similarity NPC213723
0.9463 High Similarity NPC214454
0.9463 High Similarity NPC477240
0.9463 High Similarity NPC106025
0.9463 High Similarity NPC191154
0.9459 High Similarity NPC199335
0.9423 High Similarity NPC236934
0.9423 High Similarity NPC70441
0.9423 High Similarity NPC5778
0.9419 High Similarity NPC473644
0.9419 High Similarity NPC311850
0.9419 High Similarity NPC66087
0.9419 High Similarity NPC183672
0.9419 High Similarity NPC278419
0.9419 High Similarity NPC179198
0.9416 High Similarity NPC470125
0.9416 High Similarity NPC477629
0.9416 High Similarity NPC270675
0.9416 High Similarity NPC224530
0.9416 High Similarity NPC477628
0.9416 High Similarity NPC210961
0.9416 High Similarity NPC472994
0.9416 High Similarity NPC282169
0.9416 High Similarity NPC216496
0.9416 High Similarity NPC129217
0.9416 High Similarity NPC85707
0.9416 High Similarity NPC195685
0.9416 High Similarity NPC259957
0.9416 High Similarity NPC48093
0.9416 High Similarity NPC159579
0.9412 High Similarity NPC43761
0.9404 High Similarity NPC108706
0.9404 High Similarity NPC211158
0.9404 High Similarity NPC268950
0.9404 High Similarity NPC78021
0.9404 High Similarity NPC87304
0.94 High Similarity NPC190217
0.94 High Similarity NPC134819
0.9392 High Similarity NPC23084
0.9363 High Similarity NPC92565
0.9363 High Similarity NPC160156
0.9363 High Similarity NPC45400
0.9359 High Similarity NPC287889
0.9359 High Similarity NPC76831
0.9359 High Similarity NPC135358
0.9359 High Similarity NPC292929
0.9359 High Similarity NPC289667
0.9355 High Similarity NPC77660
0.9355 High Similarity NPC27942
0.9355 High Similarity NPC127782
0.9355 High Similarity NPC189142
0.9355 High Similarity NPC300537
0.9355 High Similarity NPC150164
0.9346 High Similarity NPC288084
0.9342 High Similarity NPC470603
0.9342 High Similarity NPC470605
0.9342 High Similarity NPC470604
0.9304 High Similarity NPC105283
0.9304 High Similarity NPC270578
0.9304 High Similarity NPC43587
0.9304 High Similarity NPC293629
0.9304 High Similarity NPC5319
0.9304 High Similarity NPC472381
0.9304 High Similarity NPC170675
0.9304 High Similarity NPC472383
0.9304 High Similarity NPC112755
0.9304 High Similarity NPC471457
0.9304 High Similarity NPC52382
0.9304 High Similarity NPC229687
0.9299 High Similarity NPC221342
0.9299 High Similarity NPC142142
0.9299 High Similarity NPC11432
0.9299 High Similarity NPC477613
0.9299 High Similarity NPC186816
0.9299 High Similarity NPC256188
0.9299 High Similarity NPC262222
0.9299 High Similarity NPC476470
0.9299 High Similarity NPC68592
0.9299 High Similarity NPC115674
0.9299 High Similarity NPC203145
0.9299 High Similarity NPC189564
0.9299 High Similarity NPC12013
0.9299 High Similarity NPC298666
0.9299 High Similarity NPC64425
0.9299 High Similarity NPC8856
0.9299 High Similarity NPC32641
0.9299 High Similarity NPC210073
0.9295 High Similarity NPC309025
0.9295 High Similarity NPC121703
0.9295 High Similarity NPC88023
0.9295 High Similarity NPC270335
0.9295 High Similarity NPC243930
0.9295 High Similarity NPC191306
0.9295 High Similarity NPC19709
0.9295 High Similarity NPC80068

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC72649 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
0.9733 High Similarity NPD4381 Clinical (unspecified phase)
0.9304 High Similarity NPD7804 Clinical (unspecified phase)
0.9245 High Similarity NPD7074 Phase 3
0.9182 High Similarity NPD7054 Approved
0.9125 High Similarity NPD7472 Approved
0.9079 High Similarity NPD4380 Phase 2
0.9068 High Similarity NPD6797 Phase 2
0.9012 High Similarity NPD7251 Discontinued
0.9 High Similarity NPD3818 Discontinued
0.8957 High Similarity NPD7808 Phase 3
0.8912 High Similarity NPD1552 Clinical (unspecified phase)
0.8912 High Similarity NPD1550 Clinical (unspecified phase)
0.8851 High Similarity NPD1549 Phase 2
0.8841 High Similarity NPD4338 Clinical (unspecified phase)
0.8758 High Similarity NPD6167 Clinical (unspecified phase)
0.8758 High Similarity NPD6166 Phase 2
0.8758 High Similarity NPD6168 Clinical (unspecified phase)
0.8734 High Similarity NPD7075 Discontinued
0.8718 High Similarity NPD1934 Approved
0.8667 High Similarity NPD6559 Discontinued
0.8662 High Similarity NPD2393 Clinical (unspecified phase)
0.8599 High Similarity NPD6801 Discontinued
0.8544 High Similarity NPD7096 Clinical (unspecified phase)
0.8535 High Similarity NPD7411 Suspended
0.8516 High Similarity NPD5403 Approved
0.8506 High Similarity NPD4378 Clinical (unspecified phase)
0.8491 Intermediate Similarity NPD8443 Clinical (unspecified phase)
0.8442 Intermediate Similarity NPD6799 Approved
0.8438 Intermediate Similarity NPD4868 Clinical (unspecified phase)
0.84 Intermediate Similarity NPD1510 Phase 2
0.8387 Intermediate Similarity NPD7410 Clinical (unspecified phase)
0.8387 Intermediate Similarity NPD5401 Approved
0.8344 Intermediate Similarity NPD2796 Approved
0.8323 Intermediate Similarity NPD1511 Approved
0.8313 Intermediate Similarity NPD2801 Approved
0.8261 Intermediate Similarity NPD5402 Approved
0.8261 Intermediate Similarity NPD3817 Phase 2
0.8255 Intermediate Similarity NPD1240 Approved
0.8239 Intermediate Similarity NPD6599 Discontinued
0.8232 Intermediate Similarity NPD6959 Discontinued
0.8217 Intermediate Similarity NPD1512 Approved
0.8199 Intermediate Similarity NPD7819 Suspended
0.8166 Intermediate Similarity NPD7993 Clinical (unspecified phase)
0.8146 Intermediate Similarity NPD1607 Approved
0.8129 Intermediate Similarity NPD8312 Approved
0.8129 Intermediate Similarity NPD8313 Approved
0.8098 Intermediate Similarity NPD3882 Suspended
0.8086 Intermediate Similarity NPD8455 Phase 2
0.8084 Intermediate Similarity NPD7852 Clinical (unspecified phase)
0.8061 Intermediate Similarity NPD5494 Approved
0.8013 Intermediate Similarity NPD3750 Approved
0.8011 Intermediate Similarity NPD7879 Clinical (unspecified phase)
0.7939 Intermediate Similarity NPD3749 Approved
0.7935 Intermediate Similarity NPD7584 Approved
0.7898 Intermediate Similarity NPD4628 Phase 3
0.7898 Intermediate Similarity NPD1878 Clinical (unspecified phase)
0.7882 Intermediate Similarity NPD3751 Discontinued
0.7881 Intermediate Similarity NPD6859 Clinical (unspecified phase)
0.7879 Intermediate Similarity NPD7768 Phase 2
0.7871 Intermediate Similarity NPD1551 Phase 2
0.7866 Intermediate Similarity NPD1465 Phase 2
0.7857 Intermediate Similarity NPD3787 Discontinued
0.7836 Intermediate Similarity NPD5844 Phase 1
0.7834 Intermediate Similarity NPD7421 Clinical (unspecified phase)
0.7778 Intermediate Similarity NPD1653 Approved
0.7755 Intermediate Similarity NPD1091 Approved
0.7751 Intermediate Similarity NPD6232 Discontinued
0.7719 Intermediate Similarity NPD7473 Discontinued
0.7716 Intermediate Similarity NPD6980 Clinical (unspecified phase)
0.7705 Intermediate Similarity NPD6778 Approved
0.7705 Intermediate Similarity NPD6782 Approved
0.7705 Intermediate Similarity NPD6777 Approved
0.7705 Intermediate Similarity NPD6781 Approved
0.7705 Intermediate Similarity NPD6776 Approved
0.7705 Intermediate Similarity NPD6779 Approved
0.7705 Intermediate Similarity NPD6780 Approved
0.7692 Intermediate Similarity NPD3748 Approved
0.7692 Intermediate Similarity NPD7199 Phase 2
0.7674 Intermediate Similarity NPD7228 Approved
0.7662 Intermediate Similarity NPD1613 Approved
0.7662 Intermediate Similarity NPD1612 Clinical (unspecified phase)
0.766 Intermediate Similarity NPD8151 Discontinued
0.7658 Intermediate Similarity NPD970 Clinical (unspecified phase)
0.7637 Intermediate Similarity NPD8090 Clinical (unspecified phase)
0.7635 Intermediate Similarity NPD1547 Clinical (unspecified phase)
0.7613 Intermediate Similarity NPD1933 Approved
0.761 Intermediate Similarity NPD2800 Approved
0.7581 Intermediate Similarity NPD7698 Approved
0.7581 Intermediate Similarity NPD7435 Discontinued
0.7581 Intermediate Similarity NPD7696 Phase 3
0.7581 Intermediate Similarity NPD7697 Approved
0.758 Intermediate Similarity NPD7033 Discontinued
0.7579 Intermediate Similarity NPD7782 Clinical (unspecified phase)
0.7579 Intermediate Similarity NPD7783 Phase 2
0.7564 Intermediate Similarity NPD6651 Approved
0.755 Intermediate Similarity NPD1203 Approved
0.7543 Intermediate Similarity NPD5953 Discontinued
0.7532 Intermediate Similarity NPD2935 Discontinued
0.7529 Intermediate Similarity NPD7286 Phase 2
0.7516 Intermediate Similarity NPD6832 Phase 2
0.7516 Intermediate Similarity NPD4908 Phase 1
0.7515 Intermediate Similarity NPD7458 Discontinued
0.7513 Intermediate Similarity NPD7701 Phase 2
0.7513 Intermediate Similarity NPD7585 Approved
0.75 Intermediate Similarity NPD7685 Pre-registration
0.75 Intermediate Similarity NPD920 Approved
0.75 Intermediate Similarity NPD7184 Clinical (unspecified phase)
0.7485 Intermediate Similarity NPD642 Clinical (unspecified phase)
0.7485 Intermediate Similarity NPD37 Approved
0.7485 Intermediate Similarity NPD7004 Clinical (unspecified phase)
0.7485 Intermediate Similarity NPD2532 Approved
0.7485 Intermediate Similarity NPD2533 Approved
0.7485 Intermediate Similarity NPD2534 Approved
0.7484 Intermediate Similarity NPD7266 Discontinued
0.7471 Intermediate Similarity NPD6234 Discontinued
0.7469 Intermediate Similarity NPD643 Clinical (unspecified phase)
0.746 Intermediate Similarity NPD7583 Approved
0.7458 Intermediate Similarity NPD4419 Clinical (unspecified phase)
0.7456 Intermediate Similarity NPD4967 Phase 2
0.7456 Intermediate Similarity NPD4966 Approved
0.7456 Intermediate Similarity NPD4965 Approved
0.7447 Intermediate Similarity NPD7870 Phase 2
0.7447 Intermediate Similarity NPD7871 Phase 2
0.7436 Intermediate Similarity NPD943 Approved
0.7433 Intermediate Similarity NPD6823 Phase 2
0.7432 Intermediate Similarity NPD6534 Approved
0.7432 Intermediate Similarity NPD6535 Approved
0.7432 Intermediate Similarity NPD4363 Phase 3
0.7432 Intermediate Similarity NPD4360 Phase 2
0.7423 Intermediate Similarity NPD6143 Clinical (unspecified phase)
0.7419 Intermediate Similarity NPD2313 Discontinued
0.7419 Intermediate Similarity NPD4907 Clinical (unspecified phase)
0.7419 Intermediate Similarity NPD6798 Discontinued
0.7405 Intermediate Similarity NPD7699 Phase 2
0.7405 Intermediate Similarity NPD7700 Phase 2
0.7403 Intermediate Similarity NPD8397 Clinical (unspecified phase)
0.7403 Intermediate Similarity NPD1529 Clinical (unspecified phase)
0.74 Intermediate Similarity NPD1610 Phase 2
0.7391 Intermediate Similarity NPD1652 Phase 2
0.7391 Intermediate Similarity NPD1243 Approved
0.7389 Intermediate Similarity NPD5123 Clinical (unspecified phase)
0.7389 Intermediate Similarity NPD5124 Phase 1
0.7386 Intermediate Similarity NPD2798 Approved
0.7375 Intermediate Similarity NPD2344 Approved
0.7365 Intermediate Similarity NPD1548 Phase 1
0.7358 Intermediate Similarity NPD2799 Discontinued
0.7344 Intermediate Similarity NPD7874 Approved
0.7344 Intermediate Similarity NPD7875 Clinical (unspecified phase)
0.7338 Intermediate Similarity NPD1530 Clinical (unspecified phase)
0.7333 Intermediate Similarity NPD8055 Clinical (unspecified phase)
0.7321 Intermediate Similarity NPD7615 Clinical (unspecified phase)
0.7312 Intermediate Similarity NPD6100 Approved
0.7312 Intermediate Similarity NPD6099 Approved
0.7308 Intermediate Similarity NPD3268 Approved
0.7306 Intermediate Similarity NPD7801 Approved
0.7305 Intermediate Similarity NPD3226 Approved
0.7303 Intermediate Similarity NPD7240 Approved
0.7299 Intermediate Similarity NPD3926 Phase 2
0.7267 Intermediate Similarity NPD919 Approved
0.7263 Intermediate Similarity NPD8319 Approved
0.7263 Intermediate Similarity NPD8320 Phase 1
0.7261 Intermediate Similarity NPD6233 Phase 2
0.7257 Intermediate Similarity NPD7784 Clinical (unspecified phase)
0.7255 Intermediate Similarity NPD3225 Approved
0.7244 Intermediate Similarity NPD3027 Phase 3
0.7237 Intermediate Similarity NPD9717 Approved
0.7212 Intermediate Similarity NPD7390 Discontinued
0.7208 Intermediate Similarity NPD2797 Approved
0.7202 Intermediate Similarity NPD5808 Clinical (unspecified phase)
0.7198 Intermediate Similarity NPD8434 Phase 2
0.7195 Intermediate Similarity NPD6190 Approved
0.7195 Intermediate Similarity NPD2309 Approved
0.7189 Intermediate Similarity NPD6212 Phase 3
0.7189 Intermediate Similarity NPD6214 Clinical (unspecified phase)
0.7189 Intermediate Similarity NPD6213 Phase 3
0.7188 Intermediate Similarity NPD7097 Phase 1
0.7184 Intermediate Similarity NPD1247 Approved
0.7171 Intermediate Similarity NPD422 Phase 1
0.717 Intermediate Similarity NPD230 Phase 1
0.717 Intermediate Similarity NPD6355 Discontinued
0.7169 Intermediate Similarity NPD4661 Approved
0.7169 Intermediate Similarity NPD4662 Approved
0.716 Intermediate Similarity NPD2346 Discontinued
0.7134 Intermediate Similarity NPD6398 Clinical (unspecified phase)
0.7117 Intermediate Similarity NPD2424 Discontinued
0.7104 Intermediate Similarity NPD8150 Discontinued
0.7093 Intermediate Similarity NPD4288 Approved
0.7081 Intermediate Similarity NPD4978 Clinical (unspecified phase)
0.7076 Intermediate Similarity NPD6844 Discontinued
0.7073 Intermediate Similarity NPD2654 Approved
0.7063 Intermediate Similarity NPD1899 Clinical (unspecified phase)
0.7063 Intermediate Similarity NPD447 Suspended
0.7053 Intermediate Similarity NPD7501 Clinical (unspecified phase)
0.7045 Intermediate Similarity NPD5710 Approved
0.7045 Intermediate Similarity NPD5711 Approved
0.7037 Intermediate Similarity NPD4308 Phase 3
0.7037 Intermediate Similarity NPD1509 Clinical (unspecified phase)
0.7027 Intermediate Similarity NPD4287 Approved
0.7021 Intermediate Similarity NPD4362 Clinical (unspecified phase)
0.7021 Intermediate Similarity NPD4361 Phase 2

Structure

External Identifiers

PubChem CID   3083618
ChEMBL   CHEMBL2152489
ZINC  

Physicochemical Properties

Molecular Weight:  434.12
ALogP:  -3.5613
MLogP:  2.67
XLogP:  -0.211
# Rotatable Bonds:  10
Polar Surface Area:  166.14
# H-Bond Aceptor:  6
# H-Bond Donor:  6
# Rings:  4
# Heavy Atoms:  31

Download Data

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