Natural Product: NPC80681

Natural Product ID:  NPC80681
Common Name:   4-Methylindeno[2,1-B]Pyridin-9-One
IUPAC Name:   4-methylindeno[2,1-b]pyridin-9-one
Synonyms:  
Molecular Formula:   C13H9NO
Standard InCHIKey:  YDCSRSRWPHXQLV-UHFFFAOYSA-N
Standard InCHI:  InChI=1S/C13H9NO/c1-8-6-7-14-12-11(8)9-4-2-3-5-10(9)13(12)15/h2-7H,1H3
Canonical SMILES:  Cc1ccnc2c1c1ccccc1C2=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
NPO13861 Niphates rowi Species Niphatidae Eukaryota UNPD*
NPO3090 Verbascum undulatum Species Scrophulariaceae Eukaryota UNPD*
NPO1222 Baccharis scoparia Species Asteraceae Eukaryota UNPD*
NPO6982 Cheimophila salicella NA NA NA UNPD*
NPO1843 Laurelia sempervirens Species Atherospermataceae Eukaryota UNPD*
NPO3938 Cucurbita pepo Species Cucurbitaceae Eukaryota UNPD*

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 100 ug/ml 15686916
NPT21 Organism Aspergillus niger Aspergillus niger MIC = 100 ug/ml 15686916
NPT2 Others Unspecified MIC = 50 ug/ml 15686916
NPT770 Organism Rhizopus microsporus var. chinensis Rhizopus microsporus var. chinensis MIC > 100 ug/ml 15686916
NPT769 Organism Mucor mucedo Mucor mucedo MIC = 100 ug/ml 15686916
NPT79 Organism Bacillus subtilis Bacillus subtilis MIC = 50 ug/ml 15686916
NPT19 Organism Escherichia coli Escherichia coli MIC > 100 ug/ml 15686916
NPT766 Organism Proteus vulgaris Proteus vulgaris MIC = 100 ug/ml 15686916
NPT18 Organism Pseudomonas aeruginosa Pseudomonas aeruginosa MIC = 50 ug/ml 15686916
NPT312 Organism Saccharomyces cerevisiae Saccharomyces cerevisiae MIC > 100 ug/ml 15686916
NPT765 Organism Schizosaccharomyces pombe Schizosaccharomyces pombe MIC = 100 ug/ml 15686916
NPT767 Organism Pichia jadinii Cyberlindnera jadinii MIC = 100 ug/ml 15686916
NPT2593 Organism Rhodotorula mucilaginosa Rhodotorula mucilaginosa MIC = 100 ug/ml 15686916
NPT20 Organism Candida albicans Candida albicans MIC = 3.12 ug/ml 3325614

  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 NPC80681 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
0.9408 High Similarity NPC265100
0.8742 High Similarity NPC70949
0.8313 Intermediate Similarity NPC237188
0.8217 Intermediate Similarity NPC473878
0.8194 Intermediate Similarity NPC467188
0.8165 Intermediate Similarity NPC70406
0.8165 Intermediate Similarity NPC470679
0.8165 Intermediate Similarity NPC217021
0.8113 Intermediate Similarity NPC251391
0.8107 Intermediate Similarity NPC477042
0.8095 Intermediate Similarity NPC157583
0.8059 Intermediate Similarity NPC191415
0.7987 Intermediate Similarity NPC313889
0.7975 Intermediate Similarity NPC100726
0.7975 Intermediate Similarity NPC105811
0.7927 Intermediate Similarity NPC242116
0.7925 Intermediate Similarity NPC123906
0.7895 Intermediate Similarity NPC73994
0.7882 Intermediate Similarity NPC284775
0.7866 Intermediate Similarity NPC100104
0.7866 Intermediate Similarity NPC470680
0.784 Intermediate Similarity NPC209362
0.7805 Intermediate Similarity NPC474492
0.78 Intermediate Similarity NPC313823
0.7784 Intermediate Similarity NPC114637
0.7765 Intermediate Similarity NPC293216
0.7764 Intermediate Similarity NPC471655
0.7736 Intermediate Similarity NPC86288
0.7716 Intermediate Similarity NPC472260
0.7701 Intermediate Similarity NPC102755
0.7684 Intermediate Similarity NPC255909
0.7684 Intermediate Similarity NPC103119
0.7679 Intermediate Similarity NPC41717
0.7674 Intermediate Similarity NPC83774
0.7661 Intermediate Similarity NPC139763
0.7661 Intermediate Similarity NPC469529
0.7657 Intermediate Similarity NPC477003
0.7654 Intermediate Similarity NPC216550
0.7622 Intermediate Similarity NPC229055
0.7619 Intermediate Similarity NPC42372
0.7611 Intermediate Similarity NPC326422
0.7603 Intermediate Similarity NPC91958
0.7603 Intermediate Similarity NPC143603
0.7586 Intermediate Similarity NPC61011
0.7576 Intermediate Similarity NPC74357
0.7561 Intermediate Similarity NPC138842
0.7557 Intermediate Similarity NPC207851
0.7543 Intermediate Similarity NPC470677
0.7532 Intermediate Similarity NPC256893
0.753 Intermediate Similarity NPC213914
0.7527 Intermediate Similarity NPC128244
0.7516 Intermediate Similarity NPC65408
0.7515 Intermediate Similarity NPC115232
0.75 Intermediate Similarity NPC291517
0.75 Intermediate Similarity NPC81535
0.75 Intermediate Similarity NPC476460
0.7486 Intermediate Similarity NPC167710
0.7485 Intermediate Similarity NPC102664
0.7472 Intermediate Similarity NPC118084
0.7471 Intermediate Similarity NPC56233
0.7467 Intermediate Similarity NPC46358
0.7458 Intermediate Similarity NPC46895
0.7451 Intermediate Similarity NPC471589
0.7446 Intermediate Similarity NPC477041
0.7446 Intermediate Similarity NPC477044
0.7446 Intermediate Similarity NPC34837
0.7433 Intermediate Similarity NPC317701
0.7418 Intermediate Similarity NPC304203
0.7414 Intermediate Similarity NPC151635
0.7405 Intermediate Similarity NPC237414
0.7403 Intermediate Similarity NPC71236
0.7401 Intermediate Similarity NPC159125
0.7396 Intermediate Similarity NPC214106
0.7381 Intermediate Similarity NPC293487
0.738 Intermediate Similarity NPC106757
0.7358 Intermediate Similarity NPC169433
0.7355 Intermediate Similarity NPC282398
0.7353 Intermediate Similarity NPC478182
0.7353 Intermediate Similarity NPC274981
0.7341 Intermediate Similarity NPC262338
0.7312 Intermediate Similarity NPC477045
0.731 Intermediate Similarity NPC71132
0.7302 Intermediate Similarity NPC88115
0.7299 Intermediate Similarity NPC252572
0.7296 Intermediate Similarity NPC251722
0.7296 Intermediate Similarity NPC472288
0.7296 Intermediate Similarity NPC314102
0.7287 Intermediate Similarity NPC57398
0.7268 Intermediate Similarity NPC47190
0.7253 Intermediate Similarity NPC324091
0.7246 Intermediate Similarity NPC281094
0.7232 Intermediate Similarity NPC248462
0.7222 Intermediate Similarity NPC133003
0.7222 Intermediate Similarity NPC295158
0.7222 Intermediate Similarity NPC282103
0.7211 Intermediate Similarity NPC477043
0.7209 Intermediate Similarity NPC233380
0.7204 Intermediate Similarity NPC106824
0.7196 Intermediate Similarity NPC328318
0.7196 Intermediate Similarity NPC328596
0.7193 Intermediate Similarity NPC478185
0.7191 Intermediate Similarity NPC471997
0.7178 Intermediate Similarity NPC190296
0.7175 Intermediate Similarity NPC145885
0.7175 Intermediate Similarity NPC14113
0.7175 Intermediate Similarity NPC84827
0.7173 Intermediate Similarity NPC472065
0.7168 Intermediate Similarity NPC478183
0.7167 Intermediate Similarity NPC467063
0.7158 Intermediate Similarity NPC154339
0.7151 Intermediate Similarity NPC478184
0.7151 Intermediate Similarity NPC102592
0.7151 Intermediate Similarity NPC79356
0.7151 Intermediate Similarity NPC21174
0.7151 Intermediate Similarity NPC271797
0.7135 Intermediate Similarity NPC11126
0.7135 Intermediate Similarity NPC267343
0.7135 Intermediate Similarity NPC126709
0.7135 Intermediate Similarity NPC55772
0.7135 Intermediate Similarity NPC248041
0.7128 Intermediate Similarity NPC474767
0.7128 Intermediate Similarity NPC477004
0.7128 Intermediate Similarity NPC123395
0.7128 Intermediate Similarity NPC284338
0.7126 Intermediate Similarity NPC78020
0.7125 Intermediate Similarity NPC261195
0.7125 Intermediate Similarity NPC29886
0.712 Intermediate Similarity NPC327592
0.7119 Intermediate Similarity NPC267885
0.7118 Intermediate Similarity NPC76982
0.7108 Intermediate Similarity NPC477974
0.7108 Intermediate Similarity NPC470111
0.7105 Intermediate Similarity NPC48564
0.7105 Intermediate Similarity NPC265605
0.7105 Intermediate Similarity NPC182570
0.7102 Intermediate Similarity NPC477976
0.7099 Intermediate Similarity NPC315348
0.7099 Intermediate Similarity NPC316811
0.7099 Intermediate Similarity NPC32002
0.7098 Intermediate Similarity NPC116555
0.7095 Intermediate Similarity NPC79777
0.7095 Intermediate Similarity NPC182940
0.7092 Intermediate Similarity NPC236668
0.7091 Intermediate Similarity NPC314372
0.7086 Intermediate Similarity NPC91895
0.7086 Intermediate Similarity NPC32534
0.7083 Intermediate Similarity NPC317373
0.7083 Intermediate Similarity NPC472064
0.7081 Intermediate Similarity NPC84911
0.7081 Intermediate Similarity NPC150259
0.7072 Intermediate Similarity NPC110158
0.7067 Intermediate Similarity NPC240136
0.7067 Intermediate Similarity NPC471402
0.7067 Intermediate Similarity NPC297486
0.7065 Intermediate Similarity NPC469489
0.7063 Intermediate Similarity NPC23215
0.7062 Intermediate Similarity NPC203468
0.7062 Intermediate Similarity NPC149155
0.7062 Intermediate Similarity NPC110500
0.7056 Intermediate Similarity NPC146976
0.7055 Intermediate Similarity NPC27802
0.7048 Intermediate Similarity NPC302159
0.7045 Intermediate Similarity NPC249614
0.7045 Intermediate Similarity NPC273532
0.7044 Intermediate Similarity NPC330326
0.7043 Intermediate Similarity NPC472210
0.7043 Intermediate Similarity NPC247735
0.7043 Intermediate Similarity NPC81802
0.7043 Intermediate Similarity NPC269886
0.7043 Intermediate Similarity NPC472295
0.7039 Intermediate Similarity NPC164340
0.7039 Intermediate Similarity NPC12649
0.7039 Intermediate Similarity NPC213468
0.7039 Intermediate Similarity NPC283219
0.7035 Intermediate Similarity NPC322644
0.7027 Intermediate Similarity NPC117244
0.7027 Intermediate Similarity NPC473763
0.7027 Intermediate Similarity NPC138370
0.7021 Intermediate Similarity NPC473814
0.7021 Intermediate Similarity NPC78767
0.7019 Intermediate Similarity NPC96102
0.7018 Intermediate Similarity NPC129721
0.7017 Intermediate Similarity NPC470205
0.7016 Intermediate Similarity NPC472063
0.7016 Intermediate Similarity NPC472069
0.7016 Intermediate Similarity NPC472062
0.7013 Intermediate Similarity NPC290094
0.7012 Intermediate Similarity NPC114033
0.7012 Intermediate Similarity NPC129412
0.7012 Intermediate Similarity NPC58268
0.7012 Intermediate Similarity NPC101130
0.7006 Intermediate Similarity NPC201380
0.7006 Intermediate Similarity NPC179787
0.7005 Intermediate Similarity NPC93390
0.7005 Intermediate Similarity NPC195239
0.7005 Intermediate Similarity NPC157828
0.7 Intermediate Similarity NPC121327
0.7 Intermediate Similarity NPC148140
0.7 Intermediate Similarity NPC234403
0.6994 Remote Similarity NPC73767

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC80681 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
0.8311 Intermediate Similarity NPD1627 Clinical (unspecified phase)
0.8205 Intermediate Similarity NPD1270 Approved
0.8144 Intermediate Similarity NPD3238 Discontinued
0.8095 Intermediate Similarity NPD2753 Discontinued
0.7895 Intermediate Similarity NPD4030 Approved
0.7895 Intermediate Similarity NPD4028 Approved
0.7895 Intermediate Similarity NPD4029 Approved
0.7861 Intermediate Similarity NPD3607 Clinical (unspecified phase)
0.7818 Intermediate Similarity NPD5400 Approved
0.7784 Intermediate Similarity NPD6446 Discontinued
0.7738 Intermediate Similarity NPD1343 Approved
0.7697 Intermediate Similarity NPD1630 Approved
0.7688 Intermediate Similarity NPD1291 Clinical (unspecified phase)
0.7669 Intermediate Similarity NPD180 Clinical (unspecified phase)
0.7619 Intermediate Similarity NPD1568 Clinical (unspecified phase)
0.7616 Intermediate Similarity NPD2119 Approved
0.7616 Intermediate Similarity NPD2118 Approved
0.7586 Intermediate Similarity NPD2479 Phase 3
0.7586 Intermediate Similarity NPD2481 Approved
0.756 Intermediate Similarity NPD1631 Approved
0.756 Intermediate Similarity NPD3583 Phase 2
0.7548 Intermediate Similarity NPD3942 Approved
0.7548 Intermediate Similarity NPD3944 Approved
0.7543 Intermediate Similarity NPD4011 Clinical (unspecified phase)
0.7529 Intermediate Similarity NPD1292 Clinical (unspecified phase)
0.7528 Intermediate Similarity NPD4988 Discontinued
0.7516 Intermediate Similarity NPD201 Phase 2
0.7516 Intermediate Similarity NPD200 Phase 2
0.7514 Intermediate Similarity NPD4385 Clinical (unspecified phase)
0.75 Intermediate Similarity NPD4524 Discontinued
0.75 Intermediate Similarity NPD5965 Clinical (unspecified phase)
0.75 Intermediate Similarity NPD272 Approved
0.75 Intermediate Similarity NPD7401 Clinical (unspecified phase)
0.7472 Intermediate Similarity NPD4426 Clinical (unspecified phase)
0.7468 Intermediate Similarity NPD3475 Approved
0.7468 Intermediate Similarity NPD2896 Discontinued
0.7468 Intermediate Similarity NPD3476 Approved
0.7458 Intermediate Similarity NPD7564 Discontinued
0.7386 Intermediate Similarity NPD991 Phase 2
0.7386 Intermediate Similarity NPD992 Clinical (unspecified phase)
0.7384 Intermediate Similarity NPD1575 Approved
0.7384 Intermediate Similarity NPD1573 Approved
0.7368 Intermediate Similarity NPD4643 Clinical (unspecified phase)
0.7351 Intermediate Similarity NPD7204 Clinical (unspecified phase)
0.7337 Intermediate Similarity NPD6454 Clinical (unspecified phase)
0.7308 Intermediate Similarity NPD2336 Approved
0.7301 Intermediate Similarity NPD175 Clinical (unspecified phase)
0.7283 Intermediate Similarity NPD5975 Clinical (unspecified phase)
0.7257 Intermediate Similarity NPD1586 Approved
0.7257 Intermediate Similarity NPD4736 Clinical (unspecified phase)
0.7243 Intermediate Similarity NPD4848 Phase 1
0.7213 Intermediate Similarity NPD6180 Clinical (unspecified phase)
0.7208 Intermediate Similarity NPD9583 Approved
0.72 Intermediate Similarity NPD750 Phase 2
0.7191 Intermediate Similarity NPD3927 Phase 2
0.7189 Intermediate Similarity NPD7024 Clinical (unspecified phase)
0.7182 Intermediate Similarity NPD5809 Phase 3
0.716 Intermediate Similarity NPD9599 Approved
0.716 Intermediate Similarity NPD2580 Discontinued
0.7152 Intermediate Similarity NPD6148 Clinical (unspecified phase)
0.7151 Intermediate Similarity NPD2307 Discontinued
0.7151 Intermediate Similarity NPD5088 Discontinued
0.7143 Intermediate Similarity NPD2770 Discontinued
0.7135 Intermediate Similarity NPD460 Discontinued
0.7135 Intermediate Similarity NPD2511 Approved
0.7135 Intermediate Similarity NPD1587 Approved
0.7134 Intermediate Similarity NPD751 Clinical (unspecified phase)
0.7134 Intermediate Similarity NPD1918 Clinical (unspecified phase)
0.7134 Intermediate Similarity NPD715 Phase 3
0.7119 Intermediate Similarity NPD6471 Clinical (unspecified phase)
0.7119 Intermediate Similarity NPD749 Clinical (unspecified phase)
0.7117 Intermediate Similarity NPD1722 Approved
0.7117 Intermediate Similarity NPD5020 Approved
0.7108 Intermediate Similarity NPD4702 Approved
0.7108 Intermediate Similarity NPD4703 Approved
0.7105 Intermediate Similarity NPD268 Approved
0.7105 Intermediate Similarity NPD270 Clinical (unspecified phase)
0.7105 Intermediate Similarity NPD271 Approved
0.7101 Intermediate Similarity NPD977 Approved
0.7101 Intermediate Similarity NPD975 Approved
0.7101 Intermediate Similarity NPD2061 Approved
0.7101 Intermediate Similarity NPD976 Approved
0.7099 Intermediate Similarity NPD2074 Approved
0.7099 Intermediate Similarity NPD2069 Approved
0.7099 Intermediate Similarity NPD2068 Approved
0.7099 Intermediate Similarity NPD2072 Approved
0.7099 Intermediate Similarity NPD2075 Approved
0.7099 Intermediate Similarity NPD2071 Approved
0.7099 Intermediate Similarity NPD2070 Approved
0.7099 Intermediate Similarity NPD2073 Approved
0.7095 Intermediate Similarity NPD5473 Discontinued
0.7093 Intermediate Similarity NPD4384 Clinical (unspecified phase)
0.7088 Intermediate Similarity NPD5820 Clinical (unspecified phase)
0.7083 Intermediate Similarity NPD9343 Clinical (unspecified phase)
0.7078 Intermediate Similarity NPD9357 Approved
0.7077 Intermediate Similarity NPD6152 Phase 1
0.7065 Intermediate Similarity NPD1905 Clinical (unspecified phase)
0.7062 Intermediate Similarity NPD4883 Approved
0.7062 Intermediate Similarity NPD482 Approved
0.7059 Intermediate Similarity NPD1851 Clinical (unspecified phase)
0.7056 Intermediate Similarity NPD3178 Discontinued
0.7053 Intermediate Similarity NPD5017 Discontinued
0.7048 Intermediate Similarity NPD7469 Discontinued
0.7044 Intermediate Similarity NPD9100 Approved
0.7037 Intermediate Similarity NPD2405 Phase 3
0.7031 Intermediate Similarity NPD6288 Clinical (unspecified phase)
0.7019 Intermediate Similarity NPD198 Clinical (unspecified phase)
0.7017 Intermediate Similarity NPD3318 Approved
0.7017 Intermediate Similarity NPD3320 Approved
0.7017 Intermediate Similarity NPD3319 Phase 1
0.7017 Intermediate Similarity NPD5728 Clinical (unspecified phase)
0.7016 Intermediate Similarity NPD7187 Phase 2
0.7011 Intermediate Similarity NPD7175 Phase 1
0.7011 Intermediate Similarity NPD7234 Approved
0.7011 Intermediate Similarity NPD7233 Approved
0.7006 Intermediate Similarity NPD4547 Phase 3
0.7005 Intermediate Similarity NPD5888 Phase 2
0.7005 Intermediate Similarity NPD6787 Phase 2
0.7 Intermediate Similarity NPD2809 Approved
0.7 Intermediate Similarity NPD8248 Clinical (unspecified phase)
0.6994 Remote Similarity NPD786 Approved
0.6994 Remote Similarity NPD6771 Discontinued
0.6983 Remote Similarity NPD5755 Clinical (unspecified phase)
0.6979 Remote Similarity NPD4304 Discovery
0.6978 Remote Similarity NPD7483 Phase 2
0.6978 Remote Similarity NPD7482 Phase 2
0.6971 Remote Similarity NPD3929 Clinical (unspecified phase)
0.697 Remote Similarity NPD2007 Clinical (unspecified phase)
0.697 Remote Similarity NPD2006 Phase 2
0.6964 Remote Similarity NPD2430 Phase 2
0.6961 Remote Similarity NPD1783 Clinical (unspecified phase)
0.6959 Remote Similarity NPD3905 Phase 3
0.6954 Remote Similarity NPD1545 Discontinued
0.6951 Remote Similarity NPD107 Approved
0.6947 Remote Similarity NPD6137 Clinical (unspecified phase)
0.6943 Remote Similarity NPD6987 Phase 1
0.6943 Remote Similarity NPD3247 Clinical (unspecified phase)
0.6939 Remote Similarity NPD4051 Discontinued
0.6935 Remote Similarity NPD1658 Discontinued
0.6927 Remote Similarity NPD2881 Approved
0.6927 Remote Similarity NPD4924 Clinical (unspecified phase)
0.6927 Remote Similarity NPD2879 Approved
0.6919 Remote Similarity NPD2581 Approved
0.6919 Remote Similarity NPD2582 Approved
0.6905 Remote Similarity NPD1004 Phase 2
0.6905 Remote Similarity NPD1661 Suspended
0.6905 Remote Similarity NPD1005 Phase 2
0.6904 Remote Similarity NPD4614 Clinical (unspecified phase)
0.6902 Remote Similarity NPD3315 Phase 3
0.6898 Remote Similarity NPD4922 Phase 2
0.6898 Remote Similarity NPD7098 Clinical (unspecified phase)
0.6894 Remote Similarity NPD3385 Approved
0.6885 Remote Similarity NPD1096 Discontinued
0.6879 Remote Similarity NPD5255 Approved
0.6879 Remote Similarity NPD5418 Discontinued
0.6878 Remote Similarity NPD2290 Phase 3
0.6878 Remote Similarity NPD2289 Phase 3
0.6875 Remote Similarity NPD5636 Discontinued
0.6872 Remote Similarity NPD3839 Phase 2
0.6872 Remote Similarity NPD3840 Phase 2
0.6864 Remote Similarity NPD1183 Approved
0.686 Remote Similarity NPD6026 Approved
0.6859 Remote Similarity NPD6999 Discontinued
0.6859 Remote Similarity NPD7000 Clinical (unspecified phase)
0.6859 Remote Similarity NPD6661 Clinical (unspecified phase)
0.6857 Remote Similarity NPD6635 Approved
0.6853 Remote Similarity NPD6204 Clinical (unspecified phase)
0.6851 Remote Similarity NPD6555 Clinical (unspecified phase)
0.6849 Remote Similarity NPD9098 Phase 3
0.6849 Remote Similarity NPD9099 Clinical (unspecified phase)
0.6842 Remote Similarity NPD6664 Approved
0.6842 Remote Similarity NPD2012 Clinical (unspecified phase)
0.6837 Remote Similarity NPD7191 Phase 2
0.6837 Remote Similarity NPD2510 Approved
0.6837 Remote Similarity NPD2509 Approved
0.6835 Remote Similarity NPD1598 Discontinued
0.6833 Remote Similarity NPD4075 Phase 2
0.6832 Remote Similarity NPD1994 Approved
0.6832 Remote Similarity NPD1995 Approved
0.6832 Remote Similarity NPD1993 Approved
0.6831 Remote Similarity NPD2092 Phase 2
0.6831 Remote Similarity NPD2095 Phase 2
0.6831 Remote Similarity NPD2094 Phase 2
0.6825 Remote Similarity NPD5853 Phase 3
0.6825 Remote Similarity NPD7619 Phase 3
0.6825 Remote Similarity NPD5855 Phase 3
0.6825 Remote Similarity NPD7618 Phase 3
0.6821 Remote Similarity NPD2008 Discontinued
0.6821 Remote Similarity NPD7289 Clinical (unspecified phase)
0.6821 Remote Similarity NPD4326 Phase 2
0.6818 Remote Similarity NPD7927 Clinical (unspecified phase)
0.6818 Remote Similarity NPD2720 Phase 1
0.6818 Remote Similarity NPD2719 Clinical (unspecified phase)
0.6818 Remote Similarity NPD2915 Discontinued
0.6809 Remote Similarity NPD5505 Discontinued
0.6806 Remote Similarity NPD1982 Phase 1
0.6805 Remote Similarity NPD9271 Approved
0.6804 Remote Similarity NPD2121 Clinical (unspecified phase)
0.6802 Remote Similarity NPD1600 Suspended
0.6802 Remote Similarity NPD2295 Clinical (unspecified phase)

Structure

External Identifiers

PubChem CID   14626439
ChEMBL   CHEMBL181946
ZINC  

Physicochemical Properties

Molecular Weight:  195.07
ALogP:  0.3782
MLogP:  2.67
XLogP:  3.527
# Rotatable Bonds:  1
Polar Surface Area:  29.96
# H-Bond Aceptor:  2
# H-Bond Donor:  0
# Rings:  3
# Heavy Atoms:  15

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