Natural Product: NPC194857

Natural Product ID:  NPC194857
Common Name:   4-Ethyl-3-Methyl-N-[2-[4-[(4-Methylcyclohexyl)Carbamoylsulfamoyl]Phenyl]Ethyl]-5-Oxo-2H-Pyrrole-1-Carboxamide
IUPAC Name:   4-ethyl-3-methyl-N-[2-[4-[(4-methylcyclohexyl)carbamoylsulfamoyl]phenyl]ethyl]-5-oxo-2H-pyrrole-1-carboxamide
Synonyms:  
Molecular Formula:   C24H34N4O5S
Standard InCHIKey:  WIGIZIANZCJQQY-UHFFFAOYSA-N
Standard InCHI:  InChI=1S/C24H34N4O5S/c1-4-21-17(3)15-28(22(21)29)24(31)25-14-13-18-7-11-20(12-8-18)34(32,33)27-23(30)26-19-9-5-16(2)6-10-19/h7-8,11-12,16,19H,4-6,9-10,13-15H2,1-3H3,(H,25,31)(H2,26,27,30)
Canonical SMILES:  CCC1=C(C)CN(C1=O)C(=NCCc1ccc(cc1)S(=O)(=O)NC(=NC1CCC(CC1)C)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
NPO11872 Eleutherococcus senticosus Species Araliaceae Eukaryota TM-MC*
NPO29007 Brassica juncea Species Brassicaceae Eukaryota TM-MC*
NPO16501 Capsicum annuum Species Solanaceae Eukaryota TM-MC*
NPO13291 Changium smyrnioides Species Apiaceae Eukaryota TM-MC*
NPO5743 Salvia miltiorrhiza Species Lamiaceae Eukaryota TM-MC*
NPO784 Sinapis alba Species Brassicaceae Eukaryota TM-MC*
NPO26650 Terminalia chebula Species Combretaceae Eukaryota TM-MC*
NPO7808 Viscum album Species Viscaceae Eukaryota TM-MC*
NPO23218 Viscum coloratum Species Viscaceae Eukaryota TM-MC*
NPO20553 Zingiber officinale Species Zingiberaceae Eukaryota TM-MC*

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT211 Individual Protein Hypoxia-inducible factor 1 alpha Homo sapiens Potency = 7943.3 nM PubChem BioAssay data set
NPT55 Individual Protein Putative fructose-1,6-bisphosphate aldolase Giardia intestinalis Potency = 17740.7 nM PubChem BioAssay data set
NPT212 Individual Protein Cytochrome P450 2C9 Homo sapiens Potency = 316.2 nM PubChem BioAssay data set
NPT61 Individual Protein Beta-glucocerebrosidase Homo sapiens Potency 12589.3 nM PubChem BioAssay data set
NPT212 Individual Protein Cytochrome P450 2C9 Homo sapiens AC50 = 316.23 nM PubChem BioAssay data set
NPT445 Individual Protein Peripheral myelin protein 22 Rattus norvegicus Potency 32196.8 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency 47.3 nM PubChem BioAssay data set
NPT49 Individual Protein DNA-(apurinic or apyrimidinic site) lyase Homo sapiens Potency 199.5 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency 0.7 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency 2.7 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 NPC194857 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 NPC32858
0.7236 Intermediate Similarity NPC317400
0.6861 Remote Similarity NPC470544
0.6846 Remote Similarity NPC132636
0.6812 Remote Similarity NPC470545
0.6763 Remote Similarity NPC470546
0.6739 Remote Similarity NPC239357
0.6713 Remote Similarity NPC22746
0.6642 Remote Similarity NPC476048
0.6621 Remote Similarity NPC477937
0.662 Remote Similarity NPC71684
0.6617 Remote Similarity NPC471447
0.6571 Remote Similarity NPC476440
0.6562 Remote Similarity NPC471319
0.6562 Remote Similarity NPC471320
0.6549 Remote Similarity NPC200964
0.6541 Remote Similarity NPC143516
0.6496 Remote Similarity NPC181390
0.6496 Remote Similarity NPC475013
0.6493 Remote Similarity NPC474973
0.6493 Remote Similarity NPC45033
0.6493 Remote Similarity NPC130898
0.6493 Remote Similarity NPC474804
0.6486 Remote Similarity NPC300315
0.6475 Remote Similarity NPC33742
0.6457 Remote Similarity NPC473661
0.6454 Remote Similarity NPC254088
0.6439 Remote Similarity NPC329375
0.6438 Remote Similarity NPC101719
0.6433 Remote Similarity NPC313850
0.6419 Remote Similarity NPC111428
0.6419 Remote Similarity NPC473322
0.6418 Remote Similarity NPC473418
0.6414 Remote Similarity NPC6975
0.6405 Remote Similarity NPC89489
0.6403 Remote Similarity NPC35850
0.6403 Remote Similarity NPC276949
0.64 Remote Similarity NPC325479
0.6389 Remote Similarity NPC202521
0.6376 Remote Similarity NPC200589
0.637 Remote Similarity NPC222466
0.6357 Remote Similarity NPC246904
0.6357 Remote Similarity NPC108339
0.6333 Remote Similarity NPC255447
0.6319 Remote Similarity NPC476990
0.6319 Remote Similarity NPC27833
0.6306 Remote Similarity NPC322878
0.6294 Remote Similarity NPC220698
0.6277 Remote Similarity NPC473676
0.6235 Remote Similarity NPC286551
0.6233 Remote Similarity NPC252878
0.6231 Remote Similarity NPC256452
0.6225 Remote Similarity NPC126458
0.6222 Remote Similarity NPC275467
0.6216 Remote Similarity NPC79698
0.6197 Remote Similarity NPC473573
0.619 Remote Similarity NPC305602
0.619 Remote Similarity NPC46427
0.619 Remote Similarity NPC17497
0.6154 Remote Similarity NPC315276
0.6154 Remote Similarity NPC285926
0.6154 Remote Similarity NPC14672
0.6136 Remote Similarity NPC472258
0.6133 Remote Similarity NPC319766
0.6125 Remote Similarity NPC311658
0.6118 Remote Similarity NPC130309
0.6108 Remote Similarity NPC469243
0.6104 Remote Similarity NPC141050
0.6103 Remote Similarity NPC469974
0.6099 Remote Similarity NPC474584
0.6093 Remote Similarity NPC165726
0.6093 Remote Similarity NPC213969
0.6076 Remote Similarity NPC468984
0.6065 Remote Similarity NPC314835
0.6061 Remote Similarity NPC25565
0.6049 Remote Similarity NPC283783
0.6039 Remote Similarity NPC287401
0.6031 Remote Similarity NPC71140
0.6031 Remote Similarity NPC474974
0.6015 Remote Similarity NPC473501
0.6015 Remote Similarity NPC475439
0.6014 Remote Similarity NPC473498
0.6012 Remote Similarity NPC475544
0.6012 Remote Similarity NPC154478
0.6 Remote Similarity NPC473002
0.6 Remote Similarity NPC223207
0.5988 Remote Similarity NPC84317
0.5988 Remote Similarity NPC105717
0.5986 Remote Similarity NPC302169
0.5975 Remote Similarity NPC161069
0.5974 Remote Similarity NPC473962
0.5965 Remote Similarity NPC471771
0.5965 Remote Similarity NPC304074
0.5965 Remote Similarity NPC290755
0.5964 Remote Similarity NPC473580
0.5964 Remote Similarity NPC469903
0.5963 Remote Similarity NPC314114
0.5951 Remote Similarity NPC13470
0.5942 Remote Similarity NPC167336
0.5938 Remote Similarity NPC52748
0.5924 Remote Similarity NPC43755
0.5924 Remote Similarity NPC471265
0.5924 Remote Similarity NPC471264
0.5924 Remote Similarity NPC127741
0.5912 Remote Similarity NPC202613
0.5909 Remote Similarity NPC120251
0.5909 Remote Similarity NPC7067
0.5906 Remote Similarity NPC5719
0.5906 Remote Similarity NPC217804
0.5906 Remote Similarity NPC210377
0.5906 Remote Similarity NPC22883
0.5901 Remote Similarity NPC315266
0.5901 Remote Similarity NPC478040
0.5901 Remote Similarity NPC209509
0.5899 Remote Similarity NPC472999
0.5899 Remote Similarity NPC327481
0.5897 Remote Similarity NPC248283
0.5893 Remote Similarity NPC324850
0.5886 Remote Similarity NPC98424
0.5886 Remote Similarity NPC92784
0.5886 Remote Similarity NPC178662
0.5886 Remote Similarity NPC470884
0.5886 Remote Similarity NPC476133
0.5886 Remote Similarity NPC77992
0.5882 Remote Similarity NPC73655
0.5879 Remote Similarity NPC300443
0.5873 Remote Similarity NPC474088
0.5872 Remote Similarity NPC15068
0.5867 Remote Similarity NPC175726
0.5867 Remote Similarity NPC474082
0.5864 Remote Similarity NPC262077
0.5862 Remote Similarity NPC198254
0.5862 Remote Similarity NPC274198
0.5858 Remote Similarity NPC62104
0.5858 Remote Similarity NPC1390
0.5849 Remote Similarity NPC239762
0.5849 Remote Similarity NPC163392
0.5845 Remote Similarity NPC319579
0.5843 Remote Similarity NPC122590
0.5838 Remote Similarity NPC63040
0.5828 Remote Similarity NPC16188
0.5828 Remote Similarity NPC138775
0.5824 Remote Similarity NPC473003
0.5824 Remote Similarity NPC469902
0.5823 Remote Similarity NPC68865
0.5817 Remote Similarity NPC105114
0.5817 Remote Similarity NPC89923
0.5817 Remote Similarity NPC239990
0.5817 Remote Similarity NPC71933
0.5817 Remote Similarity NPC152850
0.5813 Remote Similarity NPC269398
0.5813 Remote Similarity NPC263493
0.5813 Remote Similarity NPC476989
0.581 Remote Similarity NPC153554
0.5802 Remote Similarity NPC201244
0.5802 Remote Similarity NPC477217
0.5802 Remote Similarity NPC471680
0.5796 Remote Similarity NPC474473
0.5795 Remote Similarity NPC475532
0.5793 Remote Similarity NPC471820
0.5793 Remote Similarity NPC471821
0.5779 Remote Similarity NPC313722
0.5779 Remote Similarity NPC469666
0.5776 Remote Similarity NPC77905
0.5771 Remote Similarity NPC276506
0.5769 Remote Similarity NPC207428
0.5765 Remote Similarity NPC24617
0.5763 Remote Similarity NPC165285
0.5759 Remote Similarity NPC473360
0.5758 Remote Similarity NPC254798
0.5758 Remote Similarity NPC2501
0.5755 Remote Similarity NPC194390
0.5755 Remote Similarity NPC224610
0.5755 Remote Similarity NPC88267
0.5755 Remote Similarity NPC113326
0.5752 Remote Similarity NPC136453
0.575 Remote Similarity NPC307357
0.575 Remote Similarity NPC476259
0.575 Remote Similarity NPC268841
0.575 Remote Similarity NPC46098
0.5746 Remote Similarity NPC161972
0.5746 Remote Similarity NPC303045
0.5745 Remote Similarity NPC55529
0.5741 Remote Similarity NPC476978
0.5732 Remote Similarity NPC135121
0.5731 Remote Similarity NPC114806
0.5731 Remote Similarity NPC471527
0.573 Remote Similarity NPC196243
0.5723 Remote Similarity NPC7817
0.5723 Remote Similarity NPC189116
0.5723 Remote Similarity NPC475168
0.5714 Remote Similarity NPC168113
0.5714 Remote Similarity NPC129486
0.5714 Remote Similarity NPC469427
0.5714 Remote Similarity NPC469426
0.5714 Remote Similarity NPC280022
0.5714 Remote Similarity NPC231986
0.5706 Remote Similarity NPC313867
0.5706 Remote Similarity NPC5620
0.5706 Remote Similarity NPC326349

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC194857 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
1.0 High Similarity NPD6076 Approved
1.0 High Similarity NPD6075 Approved
0.7803 Intermediate Similarity NPD1727 Approved
0.7426 Intermediate Similarity NPD4478 Clinical (unspecified phase)
0.7236 Intermediate Similarity NPD838 Approved
0.7222 Intermediate Similarity NPD5272 Discontinued
0.7197 Intermediate Similarity NPD480 Approved
0.7134 Intermediate Similarity NPD5840 Discontinued
0.7114 Intermediate Similarity NPD5341 Clinical (unspecified phase)
0.7089 Intermediate Similarity NPD6646 Discontinued
0.7073 Intermediate Similarity NPD837 Approved
0.7055 Intermediate Similarity NPD5780 Phase 2
0.7054 Intermediate Similarity NPD1406 Approved
0.7045 Intermediate Similarity NPD1746 Approved
0.7045 Intermediate Similarity NPD1747 Approved
0.7013 Intermediate Similarity NPD6611 Clinical (unspecified phase)
0.6987 Remote Similarity NPD7744 Clinical (unspecified phase)
0.6939 Remote Similarity NPD7622 Phase 2
0.6928 Remote Similarity NPD8362 Clinical (unspecified phase)
0.6824 Remote Similarity NPD7733 Phase 2
0.6824 Remote Similarity NPD3908 Approved
0.6815 Remote Similarity NPD7745 Clinical (unspecified phase)
0.6768 Remote Similarity NPD6839 Clinical (unspecified phase)
0.6761 Remote Similarity NPD6041 Phase 1
0.6741 Remote Similarity NPD753 Approved
0.6733 Remote Similarity NPD1045 Discontinued
0.6712 Remote Similarity NPD6729 Phase 2
0.669 Remote Similarity NPD5339 Clinical (unspecified phase)
0.6667 Remote Similarity NPD4469 Phase 3
0.6603 Remote Similarity NPD8290 Clinical (unspecified phase)
0.6573 Remote Similarity NPD1948 Approved
0.6533 Remote Similarity NPD4791 Clinical (unspecified phase)
0.6525 Remote Similarity NPD3675 Clinical (unspecified phase)
0.6503 Remote Similarity NPD1947 Approved
0.6491 Remote Similarity NPD5775 Approved
0.6491 Remote Similarity NPD5774 Approved
0.6475 Remote Similarity NPD4674 Clinical (unspecified phase)
0.6456 Remote Similarity NPD3987 Approved
0.6456 Remote Similarity NPD3988 Approved
0.6443 Remote Similarity NPD6919 Clinical (unspecified phase)
0.6438 Remote Similarity NPD2056 Discontinued
0.6405 Remote Similarity NPD6901 Phase 3
0.6376 Remote Similarity NPD7979 Clinical (unspecified phase)
0.637 Remote Similarity NPD7130 Phase 3
0.6364 Remote Similarity NPD7728 Clinical (unspecified phase)
0.6357 Remote Similarity NPD2543 Discontinued
0.6357 Remote Similarity NPD2635 Clinical (unspecified phase)
0.6354 Remote Similarity NPD6834 Approved
0.6352 Remote Similarity NPD5614 Approved
0.6352 Remote Similarity NPD5613 Approved
0.6351 Remote Similarity NPD3588 Discontinued
0.6345 Remote Similarity NPD2131 Approved
0.634 Remote Similarity NPD4782 Clinical (unspecified phase)
0.6331 Remote Similarity NPD7968 Clinical (unspecified phase)
0.6325 Remote Similarity NPD5093 Phase 2
0.6323 Remote Similarity NPD1261 Approved
0.6319 Remote Similarity NPD7342 Discontinued
0.6309 Remote Similarity NPD7828 Discontinued
0.6306 Remote Similarity NPD5432 Phase 2
0.6303 Remote Similarity NPD4567 Approved
0.6303 Remote Similarity NPD4566 Approved
0.6291 Remote Similarity NPD3632 Clinical (unspecified phase)
0.6288 Remote Similarity NPD787 Suspended
0.6284 Remote Similarity NPD3894 Discontinued
0.6282 Remote Similarity NPD8076 Discontinued
0.6282 Remote Similarity NPD3126 Approved
0.6276 Remote Similarity NPD4651 Clinical (unspecified phase)
0.627 Remote Similarity NPD9186 Approved
0.627 Remote Similarity NPD9184 Approved
0.6267 Remote Similarity NPD4125 Approved
0.6259 Remote Similarity NPD4677 Discontinued
0.6258 Remote Similarity NPD5301 Clinical (unspecified phase)
0.625 Remote Similarity NPD6378 Approved
0.6243 Remote Similarity NPD7065 Clinical (unspecified phase)
0.6241 Remote Similarity NPD5630 Phase 1
0.6235 Remote Similarity NPD8001 Phase 3
0.6234 Remote Similarity NPD5004 Approved
0.622 Remote Similarity NPD4507 Discontinued
0.6207 Remote Similarity NPD1104 Approved
0.6207 Remote Similarity NPD5961 Clinical (unspecified phase)
0.6197 Remote Similarity NPD1323 Discontinued
0.6194 Remote Similarity NPD4803 Discontinued
0.6194 Remote Similarity NPD4214 Discontinued
0.6178 Remote Similarity NPD7720 Phase 2
0.6174 Remote Similarity NPD2585 Clinical (unspecified phase)
0.6174 Remote Similarity NPD3029 Clinical (unspecified phase)
0.6154 Remote Similarity NPD4158 Clinical (unspecified phase)
0.6149 Remote Similarity NPD6088 Approved
0.6149 Remote Similarity NPD7088 Discontinued
0.6148 Remote Similarity NPD5655 Clinical (unspecified phase)
0.6145 Remote Similarity NPD4517 Clinical (unspecified phase)
0.6141 Remote Similarity NPD6201 Phase 2
0.6139 Remote Similarity NPD3513 Phase 3
0.6138 Remote Similarity NPD4163 Clinical (unspecified phase)
0.6127 Remote Similarity NPD3551 Approved
0.6127 Remote Similarity NPD6613 Clinical (unspecified phase)
0.6119 Remote Similarity NPD1795 Discontinued
0.6117 Remote Similarity NPD4133 Approved
0.6111 Remote Similarity NPD3806 Clinical (unspecified phase)
0.6107 Remote Similarity NPD6792 Phase 3
0.6107 Remote Similarity NPD5367 Discontinued
0.6103 Remote Similarity NPD488 Approved
0.6103 Remote Similarity NPD489 Approved
0.6084 Remote Similarity NPD6855 Clinical (unspecified phase)
0.6081 Remote Similarity NPD2584 Suspended
0.6081 Remote Similarity NPD6408 Phase 1
0.608 Remote Similarity NPD7563 Clinical (unspecified phase)
0.6076 Remote Similarity NPD2088 Approved
0.6076 Remote Similarity NPD2087 Approved
0.6074 Remote Similarity NPD6588 Clinical (unspecified phase)
0.6074 Remote Similarity NPD7303 Discontinued
0.6069 Remote Similarity NPD6345 Approved
0.6069 Remote Similarity NPD6343 Approved
0.6069 Remote Similarity NPD483 Approved
0.6067 Remote Similarity NPD6900 Discontinued
0.6067 Remote Similarity NPD3606 Clinical (unspecified phase)
0.6065 Remote Similarity NPD8643 Discontinued
0.6061 Remote Similarity NPD6392 Approved
0.6061 Remote Similarity NPD2603 Clinical (unspecified phase)
0.6058 Remote Similarity NPD1765 Approved
0.6058 Remote Similarity NPD1763 Approved
0.6058 Remote Similarity NPD1767 Approved
0.6058 Remote Similarity NPD1761 Approved
0.6058 Remote Similarity NPD1766 Approved
0.6054 Remote Similarity NPD5187 Clinical (unspecified phase)
0.6053 Remote Similarity NPD5263 Approved
0.6051 Remote Similarity NPD6655 Clinical (unspecified phase)
0.6049 Remote Similarity NPD7892 Clinical (unspecified phase)
0.6045 Remote Similarity NPD784 Discontinued
0.6045 Remote Similarity NPD4737 Phase 2
0.6045 Remote Similarity NPD1796 Phase 3
0.6042 Remote Similarity NPD1344 Phase 2
0.6042 Remote Similarity NPD4660 Discontinued
0.6042 Remote Similarity NPD7679 Phase 2
0.6037 Remote Similarity NPD4090 Discontinued
0.6037 Remote Similarity NPD6575 Clinical (unspecified phase)
0.6029 Remote Similarity NPD1396 Approved
0.6027 Remote Similarity NPD759 Approved
0.6026 Remote Similarity NPD3608 Clinical (unspecified phase)
0.6025 Remote Similarity NPD7602 Clinical (unspecified phase)
0.6024 Remote Similarity NPD5606 Discontinued
0.6024 Remote Similarity NPD7822 Phase 1
0.6024 Remote Similarity NPD7969 Clinical (unspecified phase)
0.6014 Remote Similarity NPD4706 Clinical (unspecified phase)
0.6014 Remote Similarity NPD7062 Discontinued
0.6013 Remote Similarity NPD5782 Phase 3
0.6012 Remote Similarity NPD5002 Discontinued
0.6012 Remote Similarity NPD4939 Clinical (unspecified phase)
0.6 Remote Similarity NPD6360 Discontinued
0.6 Remote Similarity NPD6391 Approved
0.6 Remote Similarity NPD6623 Phase 3
0.6 Remote Similarity NPD6240 Phase 3
0.6 Remote Similarity NPD7579 Clinical (unspecified phase)
0.6 Remote Similarity NPD4063 Clinical (unspecified phase)
0.6 Remote Similarity NPD8022 Clinical (unspecified phase)
0.6 Remote Similarity NPD3581 Discontinued
0.6 Remote Similarity NPD7836 Clinical (unspecified phase)
0.5988 Remote Similarity NPD5839 Clinical (unspecified phase)
0.5988 Remote Similarity NPD6396 Clinical (unspecified phase)
0.5988 Remote Similarity NPD6395 Phase 2
0.5987 Remote Similarity NPD4705 Clinical (unspecified phase)
0.5987 Remote Similarity NPD3626 Phase 3
0.5987 Remote Similarity NPD1781 Discontinued
0.5986 Remote Similarity NPD2810 Discontinued
0.5985 Remote Similarity NPD1028 Approved
0.5985 Remote Similarity NPD1026 Approved
0.5975 Remote Similarity NPD1938 Clinical (unspecified phase)
0.5975 Remote Similarity NPD4461 Discontinued
0.5975 Remote Similarity NPD2022 Approved
0.5974 Remote Similarity NPD7908 Discontinued
0.5974 Remote Similarity NPD5581 Approved
0.5973 Remote Similarity NPD3072 Approved
0.5973 Remote Similarity NPD3071 Approved
0.5973 Remote Similarity NPD3073 Approved
0.597 Remote Similarity NPD1724 Approved
0.597 Remote Similarity NPD466 Approved
0.5965 Remote Similarity NPD3850 Clinical (unspecified phase)
0.5962 Remote Similarity NPD4757 Clinical (unspecified phase)
0.596 Remote Similarity NPD5653 Discontinued
0.5957 Remote Similarity NPD2583 Phase 2
0.5956 Remote Similarity NPD813 Approved
0.5954 Remote Similarity NPD4650 Approved
0.5952 Remote Similarity NPD6885 Approved
0.5952 Remote Similarity NPD6886 Approved
0.5951 Remote Similarity NPD6631 Clinical (unspecified phase)
0.5951 Remote Similarity NPD2014 Approved
0.5951 Remote Similarity NPD5570 Discontinued
0.5951 Remote Similarity NPD2016 Approved
0.5951 Remote Similarity NPD2013 Approved
0.5944 Remote Similarity NPD3598 Phase 3
0.5944 Remote Similarity NPD5180 Approved
0.5944 Remote Similarity NPD5179 Approved
0.5944 Remote Similarity NPD5181 Approved
0.5943 Remote Similarity NPD2461 Phase 1
0.5942 Remote Similarity NPD959 Discontinued
0.5942 Remote Similarity NPD5717 Approved
0.594 Remote Similarity NPD157 Clinical (unspecified phase)
0.594 Remote Similarity NPD2507 Clinical (unspecified phase)
0.5935 Remote Similarity NPD4680 Discontinued
0.5931 Remote Similarity NPD6660 Discontinued

Structure

External Identifiers

PubChem CID   3476
ChEMBL   CHEMBL149223
ZINC  

Physicochemical Properties

Molecular Weight:  490.22
ALogP:  0.2885
MLogP:  3
XLogP:  4.487
# Rotatable Bonds:  14
Polar Surface Area:  140.04
# H-Bond Aceptor:  9
# H-Bond Donor:  3
# Rings:  3
# Heavy Atoms:  34

Download Data

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