NPASS Natural Product

Natural Product: NPC478208

Natural Product ID:	NPC478208
Common Name:	nagilactone L
IUPAC Name:
Synonyms:
Molecular Formula:	C18H22O5
Standard InCHIKey:	LQBKPKYDZQINOU-HYXQYTDDSA-N
Standard InCHI:	InChI=1S/C18H22O5/c1-4-11-9-7-12-15-17(2,16(21)23-12)6-5-13(19)18(15,3)10(9)8-14(20)22-11/h8,12-13,15,19H,4-7H2,1-3H3/t12-,13?,15+,17+,18+/m1/s1
Canonical SMILES:	CCc1oc(=O)cc2c1C[C@H]1OC(=O)[C@@]3([C@H]1[C@]2(C)C(O)CC3)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
NPO33703	Podocarpus nagi	Species	Podocarpaceae	Eukaryota	Seeds	Aihua, Lincang, Yunnan Province, China	2103-OCT	PMID[28719204]

Biological Activity

Activity Type	# Activity
n.a.	2

Activity Type	# Activity
Cell Line	2

Target ID	Target Type	Target Name	Target Organism	Activity Type	Activity Relation	Value	Unit	Reference
NPT179	Cell Line	A2780	Homo sapiens	IC50	=	3.8 ± 0.9	µM	28719204
NPT6521	Cell Line	HEY	Homo sapiens	IC50	=	6.4 ± 1.4	µM	28719204

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 NPC478208 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	144
0.1-0.2	680
0.2-0.3	2244
0.3-0.4	4011
0.4-0.5	6530
0.5-0.6	9579
0.6-0.7	5307
0.7-0.8	2240
0.8-0.85	120
0.85-0.9	19
0.9-0.95	8
0.95-1	7

Similarity Score	Similarity Level	Natural Product ID
0.97	High Similarity	NPC478210
0.9604	High Similarity	NPC478209
0.9604	High Similarity	NPC478211
0.951	High Similarity	NPC100329
0.951	High Similarity	NPC97939
0.951	High Similarity	NPC247031
0.951	High Similarity	NPC132790
0.94	High Similarity	NPC469607
0.9327	High Similarity	NPC475966
0.9327	High Similarity	NPC478212
0.9151	High Similarity	NPC478216
0.91	High Similarity	NPC273005
0.91	High Similarity	NPC31058
0.91	High Similarity	NPC469606
0.9065	High Similarity	NPC478204
0.8981	High Similarity	NPC478205
0.8981	High Similarity	NPC108581
0.8981	High Similarity	NPC478206
0.8846	High Similarity	NPC275539
0.8846	High Similarity	NPC189075
0.8774	High Similarity	NPC469655
0.8774	High Similarity	NPC469656
0.8774	High Similarity	NPC474846
0.875	High Similarity	NPC110496
0.8654	High Similarity	NPC34768
0.8611	High Similarity	NPC25909
0.8571	High Similarity	NPC302788
0.8545	High Similarity	NPC98249
0.8545	High Similarity	NPC53396
0.8544	High Similarity	NPC235369
0.8529	High Similarity	NPC47024
0.8519	High Similarity	NPC194951
0.8519	High Similarity	NPC12046
0.8515	High Similarity	NPC474343
0.8468	Intermediate Similarity	NPC284707
0.8462	Intermediate Similarity	NPC254202
0.8447	Intermediate Similarity	NPC471412
0.844	Intermediate Similarity	NPC157441
0.8426	Intermediate Similarity	NPC188738
0.84	Intermediate Similarity	NPC57117
0.84	Intermediate Similarity	NPC250075
0.8396	Intermediate Similarity	NPC180744
0.8396	Intermediate Similarity	NPC179380
0.8378	Intermediate Similarity	NPC58662
0.8378	Intermediate Similarity	NPC13713
0.8365	Intermediate Similarity	NPC476081
0.8365	Intermediate Similarity	NPC165250
0.8365	Intermediate Similarity	NPC162973
0.835	Intermediate Similarity	NPC471413
0.8349	Intermediate Similarity	NPC269530
0.8302	Intermediate Similarity	NPC102352
0.8302	Intermediate Similarity	NPC478052
0.8302	Intermediate Similarity	NPC266570
0.8273	Intermediate Similarity	NPC474271
0.8269	Intermediate Similarity	NPC472637
0.8252	Intermediate Similarity	NPC23364
0.8252	Intermediate Similarity	NPC216478
0.8241	Intermediate Similarity	NPC474243
0.8235	Intermediate Similarity	NPC234993
0.8235	Intermediate Similarity	NPC134072
0.8224	Intermediate Similarity	NPC144854
0.8224	Intermediate Similarity	NPC3316
0.8224	Intermediate Similarity	NPC230541
0.8214	Intermediate Similarity	NPC469684
0.82	Intermediate Similarity	NPC72845
0.819	Intermediate Similarity	NPC295791
0.8182	Intermediate Similarity	NPC472002
0.8173	Intermediate Similarity	NPC476767
0.8173	Intermediate Similarity	NPC117685
0.8165	Intermediate Similarity	NPC210005
0.8165	Intermediate Similarity	NPC472666
0.8155	Intermediate Similarity	NPC151681
0.8155	Intermediate Similarity	NPC121402
0.8155	Intermediate Similarity	NPC175351
0.8155	Intermediate Similarity	NPC224356
0.8155	Intermediate Similarity	NPC132753
0.8148	Intermediate Similarity	NPC154608
0.8148	Intermediate Similarity	NPC192813
0.8148	Intermediate Similarity	NPC89171
0.8148	Intermediate Similarity	NPC277017
0.8148	Intermediate Similarity	NPC476802
0.8137	Intermediate Similarity	NPC183012
0.8137	Intermediate Similarity	NPC157686
0.8137	Intermediate Similarity	NPC259042
0.8131	Intermediate Similarity	NPC127609
0.812	Intermediate Similarity	NPC477745
0.8119	Intermediate Similarity	NPC139692
0.8113	Intermediate Similarity	NPC120321
0.8113	Intermediate Similarity	NPC36688
0.8113	Intermediate Similarity	NPC471208
0.8108	Intermediate Similarity	NPC469463
0.8108	Intermediate Similarity	NPC469454
0.8108	Intermediate Similarity	NPC469496
0.8108	Intermediate Similarity	NPC471204
0.81	Intermediate Similarity	NPC280149
0.81	Intermediate Similarity	NPC212679
0.81	Intermediate Similarity	NPC220454
0.81	Intermediate Similarity	NPC469595
0.81	Intermediate Similarity	NPC158488
0.81	Intermediate Similarity	NPC221111
0.8095	Intermediate Similarity	NPC81530
0.8091	Intermediate Similarity	NPC304180
0.8091	Intermediate Similarity	NPC179798
0.8077	Intermediate Similarity	NPC476807
0.8077	Intermediate Similarity	NPC278673
0.8077	Intermediate Similarity	NPC476806
0.8073	Intermediate Similarity	NPC141350
0.8073	Intermediate Similarity	NPC137911
0.8073	Intermediate Similarity	NPC228477
0.8073	Intermediate Similarity	NPC112457
0.8073	Intermediate Similarity	NPC469370
0.807	Intermediate Similarity	NPC475041
0.8067	Intermediate Similarity	NPC221414
0.8058	Intermediate Similarity	NPC472362
0.8058	Intermediate Similarity	NPC472363
0.8058	Intermediate Similarity	NPC16967
0.8058	Intermediate Similarity	NPC154526
0.8058	Intermediate Similarity	NPC29952
0.8056	Intermediate Similarity	NPC187435
0.8056	Intermediate Similarity	NPC133422
0.8056	Intermediate Similarity	NPC67321
0.8053	Intermediate Similarity	NPC473968
0.8051	Intermediate Similarity	NPC478207
0.8051	Intermediate Similarity	NPC476008
0.8039	Intermediate Similarity	NPC469596
0.8039	Intermediate Similarity	NPC477130
0.8039	Intermediate Similarity	NPC225474
0.8039	Intermediate Similarity	NPC477129
0.8039	Intermediate Similarity	NPC148000
0.8039	Intermediate Similarity	NPC191521
0.802	Intermediate Similarity	NPC233345
0.802	Intermediate Similarity	NPC186363
0.8019	Intermediate Similarity	NPC136289
0.8019	Intermediate Similarity	NPC155332
0.8019	Intermediate Similarity	NPC32577
0.8019	Intermediate Similarity	NPC58329
0.8019	Intermediate Similarity	NPC476769
0.8019	Intermediate Similarity	NPC114540
0.8018	Intermediate Similarity	NPC222834
0.8018	Intermediate Similarity	NPC277769
0.8018	Intermediate Similarity	NPC4573
0.8	Intermediate Similarity	NPC286880
0.8	Intermediate Similarity	NPC145074
0.8	Intermediate Similarity	NPC116620
0.8	Intermediate Similarity	NPC474396
0.8	Intermediate Similarity	NPC50488
0.8	Intermediate Similarity	NPC474012
0.8	Intermediate Similarity	NPC41123
0.8	Intermediate Similarity	NPC476299
0.8	Intermediate Similarity	NPC253906
0.8	Intermediate Similarity	NPC251680
0.8	Intermediate Similarity	NPC471041
0.8	Intermediate Similarity	NPC114939
0.8	Intermediate Similarity	NPC5103
0.7982	Intermediate Similarity	NPC476479
0.7982	Intermediate Similarity	NPC21326
0.7982	Intermediate Similarity	NPC325054
0.7981	Intermediate Similarity	NPC84335
0.7981	Intermediate Similarity	NPC70145
0.7981	Intermediate Similarity	NPC473963
0.7981	Intermediate Similarity	NPC91695
0.7981	Intermediate Similarity	NPC38530
0.7963	Intermediate Similarity	NPC252296
0.7963	Intermediate Similarity	NPC189863
0.7963	Intermediate Similarity	NPC181357
0.7961	Intermediate Similarity	NPC90014
0.7949	Intermediate Similarity	NPC55602
0.7946	Intermediate Similarity	NPC56448
0.7946	Intermediate Similarity	NPC73050
0.7944	Intermediate Similarity	NPC275583
0.7944	Intermediate Similarity	NPC291154
0.7944	Intermediate Similarity	NPC159533
0.7941	Intermediate Similarity	NPC162615
0.7941	Intermediate Similarity	NPC205034
0.7941	Intermediate Similarity	NPC152778
0.7941	Intermediate Similarity	NPC147272
0.7925	Intermediate Similarity	NPC303559
0.7925	Intermediate Similarity	NPC244456
0.7925	Intermediate Similarity	NPC475958
0.7925	Intermediate Similarity	NPC168319
0.7925	Intermediate Similarity	NPC194028
0.7925	Intermediate Similarity	NPC469657
0.7921	Intermediate Similarity	NPC310479
0.7921	Intermediate Similarity	NPC232202
0.7913	Intermediate Similarity	NPC476529
0.7913	Intermediate Similarity	NPC475775
0.7909	Intermediate Similarity	NPC143706
0.7909	Intermediate Similarity	NPC472534
0.7905	Intermediate Similarity	NPC57079
0.7905	Intermediate Similarity	NPC473154
0.7905	Intermediate Similarity	NPC108368
0.7895	Intermediate Similarity	NPC473590
0.7895	Intermediate Similarity	NPC284068
0.789	Intermediate Similarity	NPC475074
0.789	Intermediate Similarity	NPC184512
0.7885	Intermediate Similarity	NPC228766
0.7885	Intermediate Similarity	NPC202833
0.7885	Intermediate Similarity	NPC284518
0.7885	Intermediate Similarity	NPC242848
0.7885	Intermediate Similarity	NPC473964

Similar Clinical/Approved Drugs

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

● The left chart: Distribution of similarity level between NPC478208 and all drugs/candidates.
● The right table: Most similar clinical/approved drugs (Tc>=0.56 or Top200).

range	Tanimoto Coefficient
0-0.1	149
0.1-0.2	1028
0.2-0.3	3013
0.3-0.4	2894
0.4-0.5	1339
0.5-0.6	461
0.6-0.7	216
0.7-0.8	58
0.8-0.85	3
0.85-0.9	0
0.9-0.95	0
0.95-1	0

Similarity Score	Similarity Level	Drug ID	Developmental Stage
0.8077	Intermediate Similarity	NPD7638	Approved
0.8	Intermediate Similarity	NPD7640	Approved
0.8	Intermediate Similarity	NPD7639	Approved
0.7736	Intermediate Similarity	NPD4225	Approved
0.7636	Intermediate Similarity	NPD6008	Approved
0.7589	Intermediate Similarity	NPD4061	Clinical (unspecified phase)
0.7544	Intermediate Similarity	NPD6053	Discontinued
0.7523	Intermediate Similarity	NPD7632	Discontinued
0.7522	Intermediate Similarity	NPD5955	Clinical (unspecified phase)
0.75	Intermediate Similarity	NPD6686	Approved
0.7321	Intermediate Similarity	NPD6402	Approved
0.7321	Intermediate Similarity	NPD5739	Approved
0.7321	Intermediate Similarity	NPD6675	Approved
0.7321	Intermediate Similarity	NPD7128	Approved
0.7315	Intermediate Similarity	NPD7902	Approved
0.73	Intermediate Similarity	NPD4752	Clinical (unspecified phase)
0.7288	Intermediate Similarity	NPD7115	Discovery
0.7281	Intermediate Similarity	NPD6372	Approved
0.7281	Intermediate Similarity	NPD6373	Approved
0.7264	Intermediate Similarity	NPD5778	Approved
0.7264	Intermediate Similarity	NPD6399	Phase 3
0.7264	Intermediate Similarity	NPD5779	Approved
0.7257	Intermediate Similarity	NPD5701	Approved
0.7257	Intermediate Similarity	NPD5697	Approved
0.7257	Intermediate Similarity	NPD5954	Clinical (unspecified phase)
0.7255	Intermediate Similarity	NPD1694	Approved
0.7236	Intermediate Similarity	NPD7507	Approved
0.7196	Intermediate Similarity	NPD7748	Approved
0.7193	Intermediate Similarity	NPD6899	Approved
0.7193	Intermediate Similarity	NPD6011	Approved
0.7193	Intermediate Similarity	NPD6881	Approved
0.7193	Intermediate Similarity	NPD5345	Clinical (unspecified phase)
0.7193	Intermediate Similarity	NPD7320	Approved
0.7184	Intermediate Similarity	NPD3618	Phase 1
0.7179	Intermediate Similarity	NPD4632	Approved
0.717	Intermediate Similarity	NPD7515	Phase 2
0.717	Intermediate Similarity	NPD6411	Approved
0.7155	Intermediate Similarity	NPD6650	Approved
0.7155	Intermediate Similarity	NPD6649	Approved
0.7143	Intermediate Similarity	NPD5328	Approved
0.713	Intermediate Similarity	NPD6013	Approved
0.713	Intermediate Similarity	NPD1698	Clinical (unspecified phase)
0.713	Intermediate Similarity	NPD6014	Approved
0.713	Intermediate Similarity	NPD6012	Approved
0.7069	Intermediate Similarity	NPD7102	Approved
0.7069	Intermediate Similarity	NPD7290	Approved
0.7069	Intermediate Similarity	NPD6883	Approved
0.7064	Intermediate Similarity	NPD4697	Phase 3
0.7063	Intermediate Similarity	NPD7319	Approved
0.7049	Intermediate Similarity	NPD8513	Phase 3
0.7049	Intermediate Similarity	NPD7503	Approved
0.7037	Intermediate Similarity	NPD7900	Approved
0.7037	Intermediate Similarity	NPD7901	Clinical (unspecified phase)
0.7009	Intermediate Similarity	NPD6401	Clinical (unspecified phase)
0.7009	Intermediate Similarity	NPD6869	Approved
0.7009	Intermediate Similarity	NPD6847	Approved
0.7009	Intermediate Similarity	NPD8130	Phase 1
0.7009	Intermediate Similarity	NPD6079	Approved
0.7009	Intermediate Similarity	NPD6617	Approved
0.7	Intermediate Similarity	NPD6009	Approved
0.7	Intermediate Similarity	NPD4755	Approved
0.6981	Remote Similarity	NPD5764	Clinical (unspecified phase)
0.6981	Remote Similarity	NPD6101	Approved
0.6967	Remote Similarity	NPD6319	Approved
0.6953	Remote Similarity	NPD7260	Phase 2
0.6949	Remote Similarity	NPD8297	Approved
0.6949	Remote Similarity	NPD6882	Approved
0.6916	Remote Similarity	NPD6698	Approved
0.6916	Remote Similarity	NPD46	Approved
0.6911	Remote Similarity	NPD8515	Approved
0.6911	Remote Similarity	NPD8516	Approved
0.6911	Remote Similarity	NPD5983	Phase 2
0.6911	Remote Similarity	NPD8517	Approved
0.6909	Remote Similarity	NPD5221	Approved
0.6909	Remote Similarity	NPD5222	Approved
0.6909	Remote Similarity	NPD5220	Clinical (unspecified phase)
0.6903	Remote Similarity	NPD5211	Phase 2
0.6899	Remote Similarity	NPD6845	Suspended
0.6881	Remote Similarity	NPD5282	Discontinued
0.688	Remote Similarity	NPD7492	Approved
0.6875	Remote Similarity	NPD5286	Approved
0.6875	Remote Similarity	NPD4700	Approved
0.6875	Remote Similarity	NPD5285	Approved
0.6875	Remote Similarity	NPD4696	Approved
0.6852	Remote Similarity	NPD8035	Phase 2
0.6852	Remote Similarity	NPD8034	Phase 2
0.6852	Remote Similarity	NPD7637	Suspended
0.6847	Remote Similarity	NPD5173	Approved
0.6829	Remote Similarity	NPD6054	Approved
0.6829	Remote Similarity	NPD6059	Approved
0.6825	Remote Similarity	NPD6616	Approved
0.6822	Remote Similarity	NPD7285	Clinical (unspecified phase)
0.6814	Remote Similarity	NPD5223	Approved
0.68	Remote Similarity	NPD7604	Phase 2
0.68	Remote Similarity	NPD8328	Phase 3
0.6796	Remote Similarity	NPD3667	Approved
0.6792	Remote Similarity	NPD3573	Approved
0.6789	Remote Similarity	NPD4202	Approved
0.6783	Remote Similarity	NPD5141	Approved
0.6777	Remote Similarity	NPD6274	Approved
0.6774	Remote Similarity	NPD6291	Clinical (unspecified phase)
0.6774	Remote Similarity	NPD6016	Approved
0.6774	Remote Similarity	NPD6015	Approved
0.6772	Remote Similarity	NPD7078	Approved
0.6772	Remote Similarity	NPD8293	Discontinued
0.6754	Remote Similarity	NPD5224	Approved
0.6754	Remote Similarity	NPD5226	Approved
0.6754	Remote Similarity	NPD5225	Approved
0.6754	Remote Similarity	NPD4633	Approved
0.6726	Remote Similarity	NPD6648	Approved
0.6721	Remote Similarity	NPD8295	Clinical (unspecified phase)
0.6721	Remote Similarity	NPD6317	Approved
0.672	Remote Similarity	NPD5988	Approved
0.672	Remote Similarity	NPD6370	Approved
0.6719	Remote Similarity	NPD7736	Approved
0.6698	Remote Similarity	NPD7334	Approved
0.6698	Remote Similarity	NPD6684	Approved
0.6698	Remote Similarity	NPD6409	Approved
0.6698	Remote Similarity	NPD7146	Approved
0.6698	Remote Similarity	NPD7521	Approved
0.6698	Remote Similarity	NPD5330	Approved
0.6698	Remote Similarity	NPD5279	Phase 3
0.6697	Remote Similarity	NPD5281	Approved
0.6697	Remote Similarity	NPD7983	Approved
0.6697	Remote Similarity	NPD5284	Approved
0.6696	Remote Similarity	NPD5174	Approved
0.6696	Remote Similarity	NPD4754	Approved
0.6696	Remote Similarity	NPD5175	Approved
0.6696	Remote Similarity	NPD6083	Phase 2
0.6696	Remote Similarity	NPD6084	Phase 2
0.6695	Remote Similarity	NPD8132	Clinical (unspecified phase)
0.6693	Remote Similarity	NPD6336	Discontinued
0.6667	Remote Similarity	NPD7327	Approved
0.6667	Remote Similarity	NPD5344	Discontinued
0.6667	Remote Similarity	NPD6314	Approved
0.6667	Remote Similarity	NPD6335	Approved
0.6667	Remote Similarity	NPD3133	Approved
0.6667	Remote Similarity	NPD3666	Approved
0.6667	Remote Similarity	NPD6356	Clinical (unspecified phase)
0.6667	Remote Similarity	NPD6412	Phase 2
0.6667	Remote Similarity	NPD6313	Approved
0.6667	Remote Similarity	NPD3665	Phase 1
0.6667	Remote Similarity	NPD4786	Approved
0.6667	Remote Similarity	NPD7328	Approved
0.6641	Remote Similarity	NPD8074	Phase 3
0.664	Remote Similarity	NPD8033	Approved
0.6639	Remote Similarity	NPD6868	Approved
0.6639	Remote Similarity	NPD6371	Approved
0.6639	Remote Similarity	NPD4634	Approved
0.6637	Remote Similarity	NPD5696	Approved
0.6637	Remote Similarity	NPD8029	Clinical (unspecified phase)
0.6613	Remote Similarity	NPD7516	Approved
0.6613	Remote Similarity	NPD7100	Approved
0.6613	Remote Similarity	NPD7101	Approved
0.6606	Remote Similarity	NPD5785	Approved
0.6606	Remote Similarity	NPD7838	Discovery
0.6604	Remote Similarity	NPD7520	Clinical (unspecified phase)
0.6602	Remote Similarity	NPD4695	Discontinued
0.6583	Remote Similarity	NPD8413	Clinical (unspecified phase)
0.6581	Remote Similarity	NPD4767	Approved
0.6581	Remote Similarity	NPD4768	Approved
0.6574	Remote Similarity	NPD6672	Approved
0.6574	Remote Similarity	NPD6903	Approved
0.6574	Remote Similarity	NPD5737	Approved
0.6574	Remote Similarity	NPD7513	Clinical (unspecified phase)
0.656	Remote Similarity	NPD8377	Approved
0.656	Remote Similarity	NPD8294	Approved
0.6545	Remote Similarity	NPD5693	Phase 1
0.6542	Remote Similarity	NPD4249	Approved
0.6542	Remote Similarity	NPD3574	Clinical (unspecified phase)
0.6525	Remote Similarity	NPD7899	Clinical (unspecified phase)
0.6518	Remote Similarity	NPD5695	Phase 3
0.6509	Remote Similarity	NPD7338	Clinical (unspecified phase)
0.6508	Remote Similarity	NPD6921	Approved
0.6508	Remote Similarity	NPD8296	Approved
0.6508	Remote Similarity	NPD6908	Approved
0.6508	Remote Similarity	NPD8378	Approved
0.6508	Remote Similarity	NPD6909	Approved
0.6508	Remote Similarity	NPD8380	Approved
0.6508	Remote Similarity	NPD8335	Approved
0.6508	Remote Similarity	NPD8379	Approved
0.6481	Remote Similarity	NPD4250	Approved
0.6481	Remote Similarity	NPD4251	Approved
0.6475	Remote Similarity	NPD8133	Approved
0.6471	Remote Similarity	NPD4729	Approved
0.6471	Remote Similarity	NPD5128	Approved
0.6471	Remote Similarity	NPD4730	Approved
0.6462	Remote Similarity	NPD6033	Approved
0.6455	Remote Similarity	NPD5207	Approved
0.6449	Remote Similarity	NPD1733	Clinical (unspecified phase)
0.6429	Remote Similarity	NPD6001	Approved
0.6415	Remote Similarity	NPD7154	Phase 3
0.6415	Remote Similarity	NPD6695	Phase 3
0.6408	Remote Similarity	NPD6697	Approved
0.6408	Remote Similarity	NPD6118	Approved
0.6408	Remote Similarity	NPD6114	Approved
0.6408	Remote Similarity	NPD6115	Approved
0.6406	Remote Similarity	NPD6067	Discontinued
0.6364	Remote Similarity	NPD4753	Phase 2
0.6364	Remote Similarity	NPD5247	Approved

Structure

External Identifiers

PubChem CID
ChEMBL
ZINC

Physicochemical Properties

Molecular Weight:	318.15
ALogP:	-0.7388
MLogP:	2.89
XLogP:	0.615
# Rotatable Bonds:	5
Polar Surface Area:	72.83
# H-Bond Aceptor:	5
# H-Bond Donor:	1
# Rings:	4
# Heavy Atoms:	23

Download Data

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