NPASS Natural Product

Natural Product: NPC53781

Natural Product ID:	NPC53781
Common Name:	Flavanthrinin
IUPAC Name:	4-methoxyphenanthrene-2,7-diol
Synonyms:	Flavanthrinin
Molecular Formula:	C15H12O3
Standard InCHIKey:	CJYQJCATAOEZRC-UHFFFAOYSA-N
Standard InCHI:	InChI=1S/C15H12O3/c1-18-14-8-12(17)7-10-3-2-9-6-11(16)4-5-13(9)15(10)14/h2-8,16-17H,1H3
Canonical SMILES:	COc1cc(O)cc2c1c1ccc(cc1cc2)O
First Find Year:
Max Developmental Stage:
Synthetic Gene Cluster:	;

Species Source

Organism ID	Organism Name	Taxonomy Level	Family	SuperKingdom	Isolation Part	Reference
NPO8787	Ariocarpus scapharostrus	Species	Cactaceae	Eukaryota		UNPD*
NPO7126	Stachys glabra	Species	Lamiaceae	Eukaryota		UNPD*
NPO1756	Cremastra appendiculata	Species	Orchidaceae	Eukaryota	tubers	PMID[16792409]
NPO13174	Aplophyllum suaveolens	NA	NA	NA		UNPD*
NPO227	Sophora tomentosa	Species	Fabaceae	Eukaryota		UNPD*
NPO11479	Sargassum siliquastrum	Species	Sargassaceae	Eukaryota		UNPD*
NPO4018	Dahlia merckii	Species	Asteraceae	Eukaryota		UNPD*
NPO15591	Tolpis webbii	Species	Asteraceae	Eukaryota		UNPD*
NPO3987	Syzygium aromaticum	Species	Myrtaceae	Eukaryota		UNPD*
NPO1756	Cremastra appendiculata	Species	Orchidaceae	Eukaryota		TCM_Taiwan*
NPO3894	Dendrobium nobile	Species	Orchidaceae	Eukaryota		TCM_Taiwan*
NPO16615	Pseudobulbus cremastrae seu pleiones	NA	NA	NA		TCMSP*
NPO1756	Cremastra appendiculata	Species	Orchidaceae	Eukaryota		TM-MC*
NPO17553	Pleione bulbocodioides	Species	Orchidaceae	Eukaryota		TM-MC*
NPO12875	Pleione yunnanensis	Species	Orchidaceae	Eukaryota		TM-MC*

Biological Activity

Activity Type	# Activity
IC50	7

Activity Type	# Activity
Cell Line	7

Target ID	Target Type	Target Name	Target Organism	Activity Type	Activity Relation	Value	Unit	Reference
NPT81	Cell Line	A549	Homo sapiens	IC50	>	5000	nM	16792409
NPT179	Cell Line	A2780	Homo sapiens	IC50	>	5000	nM	16792409
NPT181	Cell Line	Bel-7402	Homo sapiens	IC50	>	5000	nM	16792409
NPT547	Cell Line	BGC-823	Homo sapiens	IC50	>	5000	nM	16792409
NPT180	Cell Line	HCT-8	Homo sapiens	IC50	>	5000	nM	16792409
NPT83	Cell Line	MCF7	Homo sapiens	IC50	>	5000	nM	16792409
NPT1306	Cell Line	WISH	Homo sapiens	IC50	>	5000	nM	16792409

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 NPC53781 and all remaining natural products in the NPASS database.
● The right table: Most similar natural products (Tc>=0.56 or Top200).

range	Tanimoto Coefficient
0-0.1	277
0.1-0.2	1486
0.2-0.3	2640
0.3-0.4	8342
0.4-0.5	4802
0.5-0.6	2767
0.6-0.7	5881
0.7-0.8	4043
0.8-0.85	470
0.85-0.9	122
0.9-0.95	50
0.95-1	9

Similarity Score	Similarity Level	Natural Product ID
0.9917	High Similarity	NPC215300
0.9917	High Similarity	NPC38017
0.975	High Similarity	NPC228503
0.975	High Similarity	NPC138248
0.9669	High Similarity	NPC278955
0.9669	High Similarity	NPC105718
0.959	High Similarity	NPC170485
0.952	High Similarity	NPC282508
0.9508	High Similarity	NPC105031
0.9375	High Similarity	NPC37410
0.935	High Similarity	NPC113495
0.9302	High Similarity	NPC472647
0.9302	High Similarity	NPC170328
0.9302	High Similarity	NPC472648
0.9302	High Similarity	NPC133463
0.9302	High Similarity	NPC472649
0.9302	High Similarity	NPC206525
0.9302	High Similarity	NPC191462
0.9286	High Similarity	NPC254000
0.9231	High Similarity	NPC200935
0.9231	High Similarity	NPC71465
0.9231	High Similarity	NPC266453
0.9231	High Similarity	NPC266006
0.9231	High Similarity	NPC472646
0.9231	High Similarity	NPC151656
0.9231	High Similarity	NPC230919
0.9225	High Similarity	NPC258780
0.92	High Similarity	NPC473221
0.9167	High Similarity	NPC63010
0.916	High Similarity	NPC220344
0.916	High Similarity	NPC243996
0.916	High Similarity	NPC105847
0.916	High Similarity	NPC132804
0.916	High Similarity	NPC243759
0.916	High Similarity	NPC218131
0.916	High Similarity	NPC275061
0.912	High Similarity	NPC82299
0.9098	High Similarity	NPC102639
0.9091	High Similarity	NPC273623
0.9091	High Similarity	NPC12668
0.9091	High Similarity	NPC308768
0.9084	High Similarity	NPC242715
0.9084	High Similarity	NPC56329
0.9084	High Similarity	NPC22902
0.9083	High Similarity	NPC195466
0.9083	High Similarity	NPC244816
0.9083	High Similarity	NPC50521
0.9083	High Similarity	NPC221549
0.907	High Similarity	NPC469610
0.9062	High Similarity	NPC8899
0.9062	High Similarity	NPC160623
0.9055	High Similarity	NPC471519
0.9055	High Similarity	NPC471518
0.9055	High Similarity	NPC16577
0.904	High Similarity	NPC293801
0.9024	High Similarity	NPC476633
0.9016	High Similarity	NPC103916
0.9008	High Similarity	NPC30632
0.9	High Similarity	NPC160697
0.8992	High Similarity	NPC469611
0.8955	High Similarity	NPC175838
0.8955	High Similarity	NPC183709
0.8943	High Similarity	NPC100108
0.8943	High Similarity	NPC277798
0.8934	High Similarity	NPC184302
0.8931	High Similarity	NPC200557
0.8931	High Similarity	NPC69029
0.8931	High Similarity	NPC158142
0.8931	High Similarity	NPC294884
0.8931	High Similarity	NPC10314
0.8931	High Similarity	NPC241241
0.8931	High Similarity	NPC108198
0.8917	High Similarity	NPC167934
0.8915	High Similarity	NPC471983
0.8915	High Similarity	NPC471517
0.8915	High Similarity	NPC473309
0.8915	High Similarity	NPC149337
0.8898	High Similarity	NPC46978
0.8864	High Similarity	NPC143139
0.8864	High Similarity	NPC205442
0.8864	High Similarity	NPC202846
0.8855	High Similarity	NPC125649
0.8852	High Similarity	NPC131118
0.8852	High Similarity	NPC190514
0.8843	High Similarity	NPC150624
0.8843	High Similarity	NPC141090
0.8843	High Similarity	NPC203113
0.8833	High Similarity	NPC249270
0.8806	High Similarity	NPC34431
0.8806	High Similarity	NPC165026
0.8806	High Similarity	NPC73505
0.8806	High Similarity	NPC295719
0.88	High Similarity	NPC57199
0.8788	High Similarity	NPC111655
0.8788	High Similarity	NPC313081
0.877	High Similarity	NPC33270
0.877	High Similarity	NPC474933
0.877	High Similarity	NPC69261
0.8769	High Similarity	NPC15543
0.876	High Similarity	NPC222108
0.876	High Similarity	NPC96719
0.876	High Similarity	NPC808
0.8731	High Similarity	NPC212942
0.8731	High Similarity	NPC29868
0.8731	High Similarity	NPC79622
0.8712	High Similarity	NPC473107
0.8702	High Similarity	NPC218884
0.8702	High Similarity	NPC228843
0.8689	High Similarity	NPC54507
0.8689	High Similarity	NPC229147
0.8689	High Similarity	NPC85292
0.8682	High Similarity	NPC23012
0.8678	High Similarity	NPC22610
0.8678	High Similarity	NPC276737
0.8672	High Similarity	NPC223953
0.8667	High Similarity	NPC280606
0.8661	High Similarity	NPC270030
0.8657	High Similarity	NPC272157
0.8657	High Similarity	NPC90615
0.8657	High Similarity	NPC201145
0.8657	High Similarity	NPC73535
0.8657	High Similarity	NPC25111
0.8657	High Similarity	NPC6262
0.8651	High Similarity	NPC18128
0.8651	High Similarity	NPC77789
0.864	High Similarity	NPC129176
0.8626	High Similarity	NPC472590
0.8618	High Similarity	NPC25648
0.8607	High Similarity	NPC185541
0.8607	High Similarity	NPC53906
0.8607	High Similarity	NPC464
0.8605	High Similarity	NPC266555
0.8605	High Similarity	NPC471986
0.8603	High Similarity	NPC472089
0.8603	High Similarity	NPC265075
0.8593	High Similarity	NPC184613
0.8583	High Similarity	NPC296920
0.8583	High Similarity	NPC90520
0.8583	High Similarity	NPC84086
0.8582	High Similarity	NPC476639
0.8582	High Similarity	NPC114155
0.8582	High Similarity	NPC300846
0.8571	High Similarity	NPC193364
0.8571	High Similarity	NPC209199
0.8571	High Similarity	NPC103967
0.8561	High Similarity	NPC126291
0.8561	High Similarity	NPC215678
0.8561	High Similarity	NPC14224
0.8561	High Similarity	NPC161958
0.8561	High Similarity	NPC274454
0.855	High Similarity	NPC126836
0.855	High Similarity	NPC315769
0.854	High Similarity	NPC472087
0.854	High Similarity	NPC472088
0.8538	High Similarity	NPC38664
0.8538	High Similarity	NPC154866
0.8538	High Similarity	NPC53986
0.8525	High Similarity	NPC180508
0.8525	High Similarity	NPC107240
0.8525	High Similarity	NPC228287
0.8519	High Similarity	NPC35550
0.8516	High Similarity	NPC134195
0.8516	High Similarity	NPC246648
0.8516	High Similarity	NPC206487
0.8516	High Similarity	NPC86502
0.8516	High Similarity	NPC5796
0.8516	High Similarity	NPC197351
0.8516	High Similarity	NPC106914
0.8507	High Similarity	NPC11727
0.8507	High Similarity	NPC472370
0.8507	High Similarity	NPC125579
0.8507	High Similarity	NPC283009
0.8507	High Similarity	NPC261873
0.8507	High Similarity	NPC15109
0.8504	High Similarity	NPC74137
0.85	High Similarity	NPC94045
0.85	High Similarity	NPC303521
0.85	High Similarity	NPC153182
0.85	High Similarity	NPC262297
0.85	High Similarity	NPC224870
0.85	High Similarity	NPC174251
0.8496	Intermediate Similarity	NPC472524
0.8496	Intermediate Similarity	NPC32778
0.8485	Intermediate Similarity	NPC191395
0.8473	Intermediate Similarity	NPC93962
0.8468	Intermediate Similarity	NPC15860
0.8468	Intermediate Similarity	NPC470759
0.8468	Intermediate Similarity	NPC219070
0.8468	Intermediate Similarity	NPC127894
0.8467	Intermediate Similarity	NPC71046
0.8462	Intermediate Similarity	NPC473134
0.8456	Intermediate Similarity	NPC6300
0.8456	Intermediate Similarity	NPC230124
0.8456	Intermediate Similarity	NPC114171
0.8456	Intermediate Similarity	NPC32630
0.8455	Intermediate Similarity	NPC246760
0.8455	Intermediate Similarity	NPC84999
0.845	Intermediate Similarity	NPC17809
0.845	Intermediate Similarity	NPC103420
0.845	Intermediate Similarity	NPC4286

Similar Clinical/Approved Drugs

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

● The left chart: Distribution of similarity level between NPC53781 and all drugs/candidates.
● The right table: Most similar clinical/approved drugs (Tc>=0.56 or Top200).

range	Tanimoto Coefficient
0-0.1	298
0.1-0.2	1122
0.2-0.3	1232
0.3-0.4	2794
0.4-0.5	1847
0.5-0.6	1088
0.6-0.7	617
0.7-0.8	148
0.8-0.85	11
0.85-0.9	3
0.9-0.95	1
0.95-1	0

Similarity Score	Similarity Level	Drug ID	Developmental Stage
0.9055	High Similarity	NPD4625	Phase 3
0.8692	High Similarity	NPD4907	Clinical (unspecified phase)
0.8571	High Similarity	NPD1610	Phase 2
0.8538	High Similarity	NPD4908	Phase 1
0.84	Intermediate Similarity	NPD1548	Phase 1
0.8295	Intermediate Similarity	NPD4749	Approved
0.8244	Intermediate Similarity	NPD6917	Clinical (unspecified phase)
0.8154	Intermediate Similarity	NPD3600	Clinical (unspecified phase)
0.8134	Intermediate Similarity	NPD6410	Clinical (unspecified phase)
0.812	Intermediate Similarity	NPD1529	Clinical (unspecified phase)
0.8099	Intermediate Similarity	NPD2342	Discontinued
0.8045	Intermediate Similarity	NPD1530	Clinical (unspecified phase)
0.8029	Intermediate Similarity	NPD4097	Suspended
0.8015	Intermediate Similarity	NPD1612	Clinical (unspecified phase)
0.8015	Intermediate Similarity	NPD1613	Approved
0.7984	Intermediate Similarity	NPD4626	Approved
0.7955	Intermediate Similarity	NPD1283	Approved
0.7926	Intermediate Similarity	NPD3027	Phase 3
0.7907	Intermediate Similarity	NPD1651	Approved
0.7843	Intermediate Similarity	NPD6232	Discontinued
0.7823	Intermediate Similarity	NPD4750	Phase 3
0.7817	Intermediate Similarity	NPD5698	Clinical (unspecified phase)
0.7778	Intermediate Similarity	NPD2861	Phase 2
0.777	Intermediate Similarity	NPD1607	Approved
0.775	Intermediate Similarity	NPD1242	Phase 1
0.773	Intermediate Similarity	NPD6099	Approved
0.773	Intermediate Similarity	NPD6100	Approved
0.7727	Intermediate Similarity	NPD422	Phase 1
0.7727	Intermediate Similarity	NPD1281	Approved
0.7692	Intermediate Similarity	NPD7473	Discontinued
0.7687	Intermediate Similarity	NPD6696	Suspended
0.7686	Intermediate Similarity	NPD940	Approved
0.7686	Intermediate Similarity	NPD846	Approved
0.7662	Intermediate Similarity	NPD6959	Discontinued
0.7638	Intermediate Similarity	NPD7635	Approved
0.7634	Intermediate Similarity	NPD5691	Approved
0.7626	Intermediate Similarity	NPD4060	Phase 1
0.7626	Intermediate Similarity	NPD1240	Approved
0.7612	Intermediate Similarity	NPD1669	Approved
0.7597	Intermediate Similarity	NPD709	Approved
0.7594	Intermediate Similarity	NPD1611	Approved
0.7576	Intermediate Similarity	NPD2286	Discontinued
0.7574	Intermediate Similarity	NPD4624	Approved
0.7535	Intermediate Similarity	NPD1509	Clinical (unspecified phase)
0.7535	Intermediate Similarity	NPD1510	Phase 2
0.7518	Intermediate Similarity	NPD3018	Phase 2
0.7517	Intermediate Similarity	NPD3750	Approved
0.7517	Intermediate Similarity	NPD7003	Approved
0.75	Intermediate Similarity	NPD970	Clinical (unspecified phase)
0.7484	Intermediate Similarity	NPD5844	Phase 1
0.7483	Intermediate Similarity	NPD7041	Phase 2
0.7483	Intermediate Similarity	NPD7040	Clinical (unspecified phase)
0.7445	Intermediate Similarity	NPD6584	Phase 3
0.7442	Intermediate Similarity	NPD1398	Phase 1
0.7434	Intermediate Similarity	NPD37	Approved
0.7432	Intermediate Similarity	NPD7447	Phase 1
0.7432	Intermediate Similarity	NPD4378	Clinical (unspecified phase)
0.7422	Intermediate Similarity	NPD228	Approved
0.7403	Intermediate Similarity	NPD7768	Phase 2
0.7402	Intermediate Similarity	NPD5451	Approved
0.7397	Intermediate Similarity	NPD6398	Clinical (unspecified phase)
0.7389	Intermediate Similarity	NPD7229	Phase 3
0.7386	Intermediate Similarity	NPD7819	Suspended
0.7376	Intermediate Similarity	NPD3620	Phase 2
0.7376	Intermediate Similarity	NPD3619	Clinical (unspecified phase)
0.7365	Intermediate Similarity	NPD7212	Phase 2
0.7365	Intermediate Similarity	NPD7390	Discontinued
0.7365	Intermediate Similarity	NPD7213	Phase 3
0.7357	Intermediate Similarity	NPD6812	Clinical (unspecified phase)
0.7357	Intermediate Similarity	NPD6859	Clinical (unspecified phase)
0.7355	Intermediate Similarity	NPD288	Approved
0.7353	Intermediate Similarity	NPD2982	Phase 2
0.7353	Intermediate Similarity	NPD2983	Phase 2
0.7353	Intermediate Similarity	NPD5327	Phase 3
0.7338	Intermediate Similarity	NPD8443	Clinical (unspecified phase)
0.7328	Intermediate Similarity	NPD6671	Approved
0.7324	Intermediate Similarity	NPD5735	Approved
0.7315	Intermediate Similarity	NPD7004	Clinical (unspecified phase)
0.7315	Intermediate Similarity	NPD2534	Approved
0.7315	Intermediate Similarity	NPD2533	Approved
0.7315	Intermediate Similarity	NPD2532	Approved
0.7315	Intermediate Similarity	NPD7410	Clinical (unspecified phase)
0.731	Intermediate Similarity	NPD1552	Clinical (unspecified phase)
0.731	Intermediate Similarity	NPD1550	Clinical (unspecified phase)
0.7308	Intermediate Similarity	NPD5283	Phase 1
0.7308	Intermediate Similarity	NPD6234	Discontinued
0.7293	Intermediate Similarity	NPD3091	Approved
0.729	Intermediate Similarity	NPD4966	Approved
0.729	Intermediate Similarity	NPD4967	Phase 2
0.729	Intermediate Similarity	NPD4965	Approved
0.7279	Intermediate Similarity	NPD3892	Phase 2
0.7279	Intermediate Similarity	NPD2981	Phase 2
0.7273	Intermediate Similarity	NPD2393	Clinical (unspecified phase)
0.7273	Intermediate Similarity	NPD7340	Approved
0.7273	Intermediate Similarity	NPD844	Approved
0.726	Intermediate Similarity	NPD7037	Approved
0.726	Intermediate Similarity	NPD1549	Phase 2
0.7254	Intermediate Similarity	NPD2238	Phase 2
0.7254	Intermediate Similarity	NPD4140	Approved
0.7241	Intermediate Similarity	NPD5404	Approved
0.7241	Intermediate Similarity	NPD2935	Discontinued
0.7241	Intermediate Similarity	NPD5406	Approved
0.7241	Intermediate Similarity	NPD5408	Approved
0.7241	Intermediate Similarity	NPD5405	Approved
0.7237	Intermediate Similarity	NPD5808	Clinical (unspecified phase)
0.7236	Intermediate Similarity	NPD3020	Approved
0.7226	Intermediate Similarity	NPD6583	Phase 3
0.7226	Intermediate Similarity	NPD6582	Phase 2
0.7211	Intermediate Similarity	NPD6674	Discontinued
0.7206	Intermediate Similarity	NPD3092	Approved
0.7206	Intermediate Similarity	NPD1201	Approved
0.7203	Intermediate Similarity	NPD5124	Phase 1
0.7203	Intermediate Similarity	NPD5123	Clinical (unspecified phase)
0.7195	Intermediate Similarity	NPD8453	Clinical (unspecified phase)
0.7174	Intermediate Similarity	NPD8651	Approved
0.7172	Intermediate Similarity	NPD4108	Discontinued
0.7172	Intermediate Similarity	NPD3748	Approved
0.7165	Intermediate Similarity	NPD968	Approved
0.7162	Intermediate Similarity	NPD7466	Approved
0.7153	Intermediate Similarity	NPD6353	Approved
0.7153	Intermediate Similarity	NPD2232	Approved
0.7153	Intermediate Similarity	NPD1608	Approved
0.7153	Intermediate Similarity	NPD2233	Approved
0.7153	Intermediate Similarity	NPD2230	Approved
0.7153	Intermediate Similarity	NPD4579	Clinical (unspecified phase)
0.7152	Intermediate Similarity	NPD6746	Phase 2
0.7143	Intermediate Similarity	NPD7411	Suspended
0.7134	Intermediate Similarity	NPD3749	Approved
0.7133	Intermediate Similarity	NPD1511	Approved
0.7133	Intermediate Similarity	NPD2979	Phase 3
0.7131	Intermediate Similarity	NPD2860	Approved
0.7131	Intermediate Similarity	NPD2859	Approved
0.7124	Intermediate Similarity	NPD3226	Approved
0.7123	Intermediate Similarity	NPD1551	Phase 2
0.7122	Intermediate Similarity	NPD3094	Phase 2
0.7121	Intermediate Similarity	NPD497	Approved
0.7107	Intermediate Similarity	NPD7199	Phase 2
0.7097	Intermediate Similarity	NPD1934	Approved
0.7095	Intermediate Similarity	NPD7421	Clinical (unspecified phase)
0.7081	Intermediate Similarity	NPD7852	Clinical (unspecified phase)
0.7078	Intermediate Similarity	NPD4380	Phase 2
0.7059	Intermediate Similarity	NPD1778	Approved
0.7059	Intermediate Similarity	NPD3019	Approved
0.7059	Intermediate Similarity	NPD4059	Approved
0.7049	Intermediate Similarity	NPD2933	Approved
0.7049	Intermediate Similarity	NPD2934	Approved
0.7045	Intermediate Similarity	NPD495	Approved
0.7045	Intermediate Similarity	NPD496	Approved
0.7045	Intermediate Similarity	NPD498	Approved
0.704	Intermediate Similarity	NPD289	Clinical (unspecified phase)
0.7039	Intermediate Similarity	NPD1512	Approved
0.7039	Intermediate Similarity	NPD4319	Phase 2
0.7039	Intermediate Similarity	NPD5261	Clinical (unspecified phase)
0.703	Intermediate Similarity	NPD6559	Discontinued
0.7019	Intermediate Similarity	NPD7184	Clinical (unspecified phase)
0.7013	Intermediate Similarity	NPD4005	Discontinued
0.7007	Intermediate Similarity	NPD2438	Suspended
0.7007	Intermediate Similarity	NPD2796	Approved
0.7	Intermediate Similarity	NPD1470	Approved
0.7	Intermediate Similarity	NPD3021	Approved
0.7	Intermediate Similarity	NPD4339	Clinical (unspecified phase)
0.7	Intermediate Similarity	NPD3022	Approved
0.7	Intermediate Similarity	NPD2797	Approved
0.6994	Remote Similarity	NPD7228	Approved
0.6993	Remote Similarity	NPD3764	Approved
0.6992	Remote Similarity	NPD1809	Phase 2
0.6985	Remote Similarity	NPD4093	Discontinued
0.6977	Remote Similarity	NPD290	Approved
0.697	Remote Similarity	NPD5535	Approved
0.6967	Remote Similarity	NPD845	Approved
0.6962	Remote Similarity	NPD4581	Clinical (unspecified phase)
0.6962	Remote Similarity	NPD4868	Clinical (unspecified phase)
0.6959	Remote Similarity	NPD5763	Approved
0.6959	Remote Similarity	NPD3540	Phase 1
0.6959	Remote Similarity	NPD5762	Approved
0.6959	Remote Similarity	NPD2029	Clinical (unspecified phase)
0.6959	Remote Similarity	NPD2346	Discontinued
0.6954	Remote Similarity	NPD6815	Approved
0.6943	Remote Similarity	NPD5929	Approved
0.6943	Remote Similarity	NPD2801	Approved
0.6943	Remote Similarity	NPD1465	Phase 2
0.6934	Remote Similarity	NPD5846	Approved
0.6934	Remote Similarity	NPD17	Approved
0.6934	Remote Similarity	NPD6516	Phase 2
0.6934	Remote Similarity	NPD2668	Approved
0.6934	Remote Similarity	NPD2932	Approved
0.6934	Remote Similarity	NPD2667	Approved
0.6934	Remote Similarity	NPD3095	Discontinued
0.6928	Remote Similarity	NPD1940	Clinical (unspecified phase)
0.6923	Remote Similarity	NPD2684	Approved
0.6923	Remote Similarity	NPD7095	Approved
0.6923	Remote Similarity	NPD7615	Clinical (unspecified phase)
0.6918	Remote Similarity	NPD4055	Discovery
0.6918	Remote Similarity	NPD7075	Discontinued
0.6918	Remote Similarity	NPD2157	Approved
0.6917	Remote Similarity	NPD4869	Clinical (unspecified phase)
0.6911	Remote Similarity	NPD1432	Clinical (unspecified phase)
0.6906	Remote Similarity	NPD1840	Phase 2
0.6901	Remote Similarity	NPD5736	Approved
0.6897	Remote Similarity	NPD1558	Phase 1

Structure

External Identifiers

PubChem CID	14777892
ChEMBL	CHEMBL447210
ZINC

Physicochemical Properties

Molecular Weight:	240.08
ALogP:	-0.9724
MLogP:	2.78
XLogP:	2.912
# Rotatable Bonds:	4
Polar Surface Area:	49.69
# H-Bond Aceptor:	0
# H-Bond Donor:	2
# Rings:	3
# Heavy Atoms:	18

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