NPASS Natural Product

Natural Product: NPC477490

Natural Product ID:	NPC477490
Common Name:	n.a.
IUPAC Name:
Synonyms:
Molecular Formula:	C40H62O13
Standard InCHIKey:	XMNBXDAHYPHWHB-YPKOQSJYSA-N
Standard InCHI:	InChI=1S/C40H62O13/c1-10-19(2)35(45)51-32-33-37(6)14-12-24(17-23(37)11-15-39(33)40(53-39)16-13-25(20(3)41)38(40,7)34(32)44)50-27-18-26(46-8)30(22(5)48-27)52-36-29(43)31(47-9)28(42)21(4)49-36/h10,21-34,36,42-44H,11-18H2,1-9H3/b19-10+/t21-,22-,23+,24+,25-,26-,27+,28-,29-,30-,31-,32+,33-,34-,36+,37+,38+,39+,40-/m1/s1
Canonical SMILES:	CO[C@@H]1C[C@H](O[C@H]2CC[C@]3([C@H](C2)CC[C@@]24[C@@H]3[C@H](OC(=O)/C(=C/C)/C)[C@@H](O)[C@]3([C@]4(O2)CC[C@@H]3C(=O)C)C)C)O[C@@H]([C@H]1O[C@@H]1O[C@H](C)[C@H]([C@H]([C@H]1O)OC)O)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
NPO23320	Marsdenia tenacissima	Species	Apocynaceae	Eukaryota	stems	Simao County, Yunnan Province, China	2005-MAR	PMID[25215856]

Biological Activity

Activity Type	# Activity
IC50	2
Others	1

Activity Type	# Activity
Others	3

Target ID	Target Type	Target Name	Activity Type	Activity Relation	Value	Unit	Reference
NPT2	Others	Unspecified	Ratio IC50	=	213		25215856
NPT2	Others	Unspecified	IC50	=	120	nM	25215856
NPT2	Others	Unspecified	IC50	=	25600	nM	25215856

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 NPC477490 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	221
0.1-0.2	1454
0.2-0.3	3678
0.3-0.4	5745
0.4-0.5	8592
0.5-0.6	5627
0.6-0.7	3434
0.7-0.8	1930
0.8-0.85	171
0.85-0.9	35
0.9-0.95	0
0.95-1	2

Similarity Score	Similarity Level	Natural Product ID
1.0	High Similarity	NPC114306
0.9832	High Similarity	NPC477493
0.881	High Similarity	NPC93416
0.8803	High Similarity	NPC477489
0.879	High Similarity	NPC329784
0.879	High Similarity	NPC240070
0.874	High Similarity	NPC477709
0.874	High Similarity	NPC476221
0.873	High Similarity	NPC16569
0.873	High Similarity	NPC253456
0.873	High Similarity	NPC159338
0.8692	High Similarity	NPC79250
0.8692	High Similarity	NPC290746
0.8682	High Similarity	NPC59288
0.8661	High Similarity	NPC471855
0.8661	High Similarity	NPC42670
0.8661	High Similarity	NPC19124
0.8651	High Similarity	NPC276838
0.8651	High Similarity	NPC125077
0.8651	High Similarity	NPC329986
0.8651	High Similarity	NPC232785
0.8651	High Similarity	NPC140092
0.8651	High Similarity	NPC91
0.8651	High Similarity	NPC188234
0.8594	High Similarity	NPC142756
0.8594	High Similarity	NPC32793
0.8594	High Similarity	NPC116075
0.8594	High Similarity	NPC104585
0.8594	High Similarity	NPC298783
0.8594	High Similarity	NPC146857
0.8594	High Similarity	NPC157817
0.8594	High Similarity	NPC247190
0.8594	High Similarity	NPC469749
0.8594	High Similarity	NPC225385
0.8548	High Similarity	NPC27363
0.8527	High Similarity	NPC329636
0.8504	High Similarity	NPC471407
0.8492	Intermediate Similarity	NPC471356
0.8492	Intermediate Similarity	NPC117702
0.8492	Intermediate Similarity	NPC471357
0.8492	Intermediate Similarity	NPC179412
0.8492	Intermediate Similarity	NPC146456
0.8492	Intermediate Similarity	NPC469757
0.8487	Intermediate Similarity	NPC477492
0.8468	Intermediate Similarity	NPC28532
0.8462	Intermediate Similarity	NPC194716
0.845	Intermediate Similarity	NPC316915
0.8438	Intermediate Similarity	NPC173347
0.8413	Intermediate Similarity	NPC469750
0.8413	Intermediate Similarity	NPC250556
0.8397	Intermediate Similarity	NPC329675
0.8372	Intermediate Similarity	NPC231240
0.8359	Intermediate Similarity	NPC180079
0.8359	Intermediate Similarity	NPC471358
0.8359	Intermediate Similarity	NPC469754
0.8359	Intermediate Similarity	NPC476966
0.8359	Intermediate Similarity	NPC471361
0.8359	Intermediate Similarity	NPC251866
0.8359	Intermediate Similarity	NPC9499
0.8359	Intermediate Similarity	NPC70542
0.8359	Intermediate Similarity	NPC89514
0.8359	Intermediate Similarity	NPC10823
0.8359	Intermediate Similarity	NPC471360
0.8359	Intermediate Similarity	NPC469753
0.8359	Intermediate Similarity	NPC6108
0.8359	Intermediate Similarity	NPC197707
0.8359	Intermediate Similarity	NPC469755
0.8359	Intermediate Similarity	NPC471359
0.8359	Intermediate Similarity	NPC86159
0.8359	Intermediate Similarity	NPC469751
0.8359	Intermediate Similarity	NPC219085
0.8359	Intermediate Similarity	NPC469752
0.8359	Intermediate Similarity	NPC284406
0.8359	Intermediate Similarity	NPC471352
0.8359	Intermediate Similarity	NPC17896
0.8333	Intermediate Similarity	NPC472719
0.8333	Intermediate Similarity	NPC207845
0.8321	Intermediate Similarity	NPC171619
0.832	Intermediate Similarity	NPC264336
0.8306	Intermediate Similarity	NPC474466
0.8306	Intermediate Similarity	NPC475556
0.8306	Intermediate Similarity	NPC475136
0.8306	Intermediate Similarity	NPC475629
0.8306	Intermediate Similarity	NPC470312
0.8306	Intermediate Similarity	NPC281840
0.8281	Intermediate Similarity	NPC311534
0.8258	Intermediate Similarity	NPC62172
0.8258	Intermediate Similarity	NPC289700
0.825	Intermediate Similarity	NPC274833
0.824	Intermediate Similarity	NPC314535
0.824	Intermediate Similarity	NPC173555
0.8231	Intermediate Similarity	NPC473519
0.8231	Intermediate Similarity	NPC473805
0.8226	Intermediate Similarity	NPC30483
0.8226	Intermediate Similarity	NPC469756
0.8226	Intermediate Similarity	NPC236973
0.8226	Intermediate Similarity	NPC329905
0.8226	Intermediate Similarity	NPC292467
0.8226	Intermediate Similarity	NPC470897
0.8226	Intermediate Similarity	NPC55532
0.8226	Intermediate Similarity	NPC32177
0.8222	Intermediate Similarity	NPC48414
0.8222	Intermediate Similarity	NPC5153
0.8217	Intermediate Similarity	NPC231529
0.8211	Intermediate Similarity	NPC473304
0.8203	Intermediate Similarity	NPC42399
0.8203	Intermediate Similarity	NPC298841
0.8168	Intermediate Similarity	NPC102015
0.816	Intermediate Similarity	NPC108072
0.816	Intermediate Similarity	NPC72260
0.8154	Intermediate Similarity	NPC471170
0.8145	Intermediate Similarity	NPC83287
0.814	Intermediate Similarity	NPC270109
0.814	Intermediate Similarity	NPC245094
0.814	Intermediate Similarity	NPC473620
0.8134	Intermediate Similarity	NPC75616
0.813	Intermediate Similarity	NPC472718
0.813	Intermediate Similarity	NPC88945
0.813	Intermediate Similarity	NPC471816
0.8125	Intermediate Similarity	NPC473635
0.812	Intermediate Similarity	NPC190065
0.812	Intermediate Similarity	NPC34562
0.812	Intermediate Similarity	NPC127656
0.812	Intermediate Similarity	NPC141215
0.812	Intermediate Similarity	NPC471089
0.811	Intermediate Similarity	NPC117445
0.811	Intermediate Similarity	NPC208193
0.811	Intermediate Similarity	NPC308262
0.8106	Intermediate Similarity	NPC248703
0.8102	Intermediate Similarity	NPC471172
0.8095	Intermediate Similarity	NPC475419
0.8095	Intermediate Similarity	NPC40749
0.8095	Intermediate Similarity	NPC120390
0.8095	Intermediate Similarity	NPC475219
0.8095	Intermediate Similarity	NPC231518
0.8095	Intermediate Similarity	NPC475590
0.8095	Intermediate Similarity	NPC202051
0.8095	Intermediate Similarity	NPC474908
0.8092	Intermediate Similarity	NPC478154
0.8092	Intermediate Similarity	NPC155529
0.8083	Intermediate Similarity	NPC8431
0.8077	Intermediate Similarity	NPC175186
0.8077	Intermediate Similarity	NPC477196
0.8077	Intermediate Similarity	NPC104382
0.8065	Intermediate Similarity	NPC470778
0.8065	Intermediate Similarity	NPC309034
0.8065	Intermediate Similarity	NPC78836
0.8065	Intermediate Similarity	NPC142066
0.8065	Intermediate Similarity	NPC157376
0.8065	Intermediate Similarity	NPC471354
0.8065	Intermediate Similarity	NPC244402
0.8065	Intermediate Similarity	NPC87250
0.8065	Intermediate Similarity	NPC473852
0.8065	Intermediate Similarity	NPC158344
0.8065	Intermediate Similarity	NPC243196
0.8065	Intermediate Similarity	NPC471351
0.8065	Intermediate Similarity	NPC471355
0.8065	Intermediate Similarity	NPC474418
0.8065	Intermediate Similarity	NPC196429
0.8065	Intermediate Similarity	NPC77319
0.8065	Intermediate Similarity	NPC471353
0.8065	Intermediate Similarity	NPC34390
0.8065	Intermediate Similarity	NPC99728
0.8065	Intermediate Similarity	NPC477252
0.8065	Intermediate Similarity	NPC27507
0.8065	Intermediate Similarity	NPC146432
0.8065	Intermediate Similarity	NPC50305
0.8065	Intermediate Similarity	NPC290693
0.8065	Intermediate Similarity	NPC93883
0.8065	Intermediate Similarity	NPC152615
0.8065	Intermediate Similarity	NPC84987
0.8062	Intermediate Similarity	NPC470516
0.8062	Intermediate Similarity	NPC470780
0.8062	Intermediate Similarity	NPC287423
0.806	Intermediate Similarity	NPC140045
0.806	Intermediate Similarity	NPC596
0.806	Intermediate Similarity	NPC295885
0.8047	Intermediate Similarity	NPC32868
0.8047	Intermediate Similarity	NPC318135
0.8047	Intermediate Similarity	NPC241456
0.8047	Intermediate Similarity	NPC469790
0.8045	Intermediate Similarity	NPC262813
0.8045	Intermediate Similarity	NPC158350
0.8043	Intermediate Similarity	NPC194854
0.8043	Intermediate Similarity	NPC48813
0.8033	Intermediate Similarity	NPC476964
0.8031	Intermediate Similarity	NPC193893
0.8031	Intermediate Similarity	NPC474423
0.8031	Intermediate Similarity	NPC74259
0.803	Intermediate Similarity	NPC88668
0.803	Intermediate Similarity	NPC478151
0.8016	Intermediate Similarity	NPC471406
0.8016	Intermediate Similarity	NPC48692
0.8016	Intermediate Similarity	NPC476150
0.8016	Intermediate Similarity	NPC476127
0.8016	Intermediate Similarity	NPC135369
0.8016	Intermediate Similarity	NPC251226
0.8015	Intermediate Similarity	NPC478155
0.8015	Intermediate Similarity	NPC477197
0.8015	Intermediate Similarity	NPC25998

Similar Clinical/Approved Drugs

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

● The left chart: Distribution of similarity level between NPC477490 and all drugs/candidates.
● The right table: Most similar clinical/approved drugs (Tc>=0.56 or Top200).

range	Tanimoto Coefficient
0-0.1	244
0.1-0.2	2196
0.2-0.3	3834
0.3-0.4	1842
0.4-0.5	539
0.5-0.6	311
0.6-0.7	144
0.7-0.8	37
0.8-0.85	14
0.85-0.9	0
0.9-0.95	0
0.95-1	0

Similarity Score	Similarity Level	Drug ID	Developmental Stage
0.8413	Intermediate Similarity	NPD7507	Approved
0.8359	Intermediate Similarity	NPD7319	Approved
0.824	Intermediate Similarity	NPD8380	Approved
0.824	Intermediate Similarity	NPD8296	Approved
0.824	Intermediate Similarity	NPD8379	Approved
0.824	Intermediate Similarity	NPD8378	Approved
0.824	Intermediate Similarity	NPD8335	Approved
0.8226	Intermediate Similarity	NPD7516	Approved
0.816	Intermediate Similarity	NPD8377	Approved
0.816	Intermediate Similarity	NPD8294	Approved
0.8145	Intermediate Similarity	NPD7328	Approved
0.8145	Intermediate Similarity	NPD7327	Approved
0.8115	Intermediate Similarity	NPD8133	Approved
0.8095	Intermediate Similarity	NPD8033	Approved
0.775	Intermediate Similarity	NPD8170	Clinical (unspecified phase)
0.7727	Intermediate Similarity	NPD7736	Approved
0.7692	Intermediate Similarity	NPD8328	Phase 3
0.7674	Intermediate Similarity	NPD7503	Approved
0.7561	Intermediate Similarity	NPD6686	Approved
0.748	Intermediate Similarity	NPD6412	Phase 2
0.7388	Intermediate Similarity	NPD8293	Discontinued
0.7364	Intermediate Similarity	NPD7115	Discovery
0.736	Intermediate Similarity	NPD8132	Clinical (unspecified phase)
0.7348	Intermediate Similarity	NPD6370	Approved
0.7323	Intermediate Similarity	NPD8297	Approved
0.7323	Intermediate Similarity	NPD6882	Approved
0.728	Intermediate Similarity	NPD5345	Clinical (unspecified phase)
0.7239	Intermediate Similarity	NPD7492	Approved
0.7231	Intermediate Similarity	NPD6009	Approved
0.7231	Intermediate Similarity	NPD8295	Clinical (unspecified phase)
0.7222	Intermediate Similarity	NPD4061	Clinical (unspecified phase)
0.7197	Intermediate Similarity	NPD6319	Approved
0.7197	Intermediate Similarity	NPD6054	Approved
0.7185	Intermediate Similarity	NPD6616	Approved
0.7165	Intermediate Similarity	NPD5955	Clinical (unspecified phase)
0.7143	Intermediate Similarity	NPD8516	Approved
0.7143	Intermediate Similarity	NPD8515	Approved
0.7143	Intermediate Similarity	NPD8513	Phase 3
0.7143	Intermediate Similarity	NPD8517	Approved
0.7132	Intermediate Similarity	NPD4632	Approved
0.7132	Intermediate Similarity	NPD7078	Approved
0.7109	Intermediate Similarity	NPD6649	Approved
0.7109	Intermediate Similarity	NPD6650	Approved
0.7087	Intermediate Similarity	NPD6373	Approved
0.7087	Intermediate Similarity	NPD6372	Approved
0.7068	Intermediate Similarity	NPD6059	Approved
0.7049	Intermediate Similarity	NPD7638	Approved
0.7015	Intermediate Similarity	NPD6016	Approved
0.7015	Intermediate Similarity	NPD6015	Approved
0.7008	Intermediate Similarity	NPD6899	Approved
0.7008	Intermediate Similarity	NPD6881	Approved
0.6992	Remote Similarity	NPD7640	Approved
0.6992	Remote Similarity	NPD7639	Approved
0.6984	Remote Similarity	NPD7128	Approved
0.6984	Remote Similarity	NPD6675	Approved
0.6984	Remote Similarity	NPD6008	Approved
0.6984	Remote Similarity	NPD5739	Approved
0.6984	Remote Similarity	NPD6402	Approved
0.6977	Remote Similarity	NPD8130	Phase 1
0.6963	Remote Similarity	NPD5988	Approved
0.6929	Remote Similarity	NPD5954	Clinical (unspecified phase)
0.6929	Remote Similarity	NPD5697	Approved
0.6917	Remote Similarity	NPD8171	Discontinued
0.6912	Remote Similarity	NPD7604	Phase 2
0.6899	Remote Similarity	NPD7102	Approved
0.6899	Remote Similarity	NPD6883	Approved
0.6899	Remote Similarity	NPD7290	Approved
0.6875	Remote Similarity	NPD7320	Approved
0.6846	Remote Similarity	NPD6847	Approved
0.6846	Remote Similarity	NPD6617	Approved
0.6846	Remote Similarity	NPD6869	Approved
0.6822	Remote Similarity	NPD6012	Approved
0.6822	Remote Similarity	NPD6013	Approved
0.6822	Remote Similarity	NPD6014	Approved
0.6797	Remote Similarity	NPD5701	Approved
0.6765	Remote Similarity	NPD6921	Approved
0.6765	Remote Similarity	NPD5983	Phase 2
0.6744	Remote Similarity	NPD6011	Approved
0.6733	Remote Similarity	NPD7625	Phase 1
0.6691	Remote Similarity	NPD6336	Discontinued
0.6641	Remote Similarity	NPD4634	Approved
0.6614	Remote Similarity	NPD5211	Phase 2
0.6596	Remote Similarity	NPD6033	Approved
0.6591	Remote Similarity	NPD6401	Clinical (unspecified phase)
0.6591	Remote Similarity	NPD8413	Clinical (unspecified phase)
0.6587	Remote Similarity	NPD5285	Approved
0.6587	Remote Similarity	NPD5286	Approved
0.6587	Remote Similarity	NPD4696	Approved
0.656	Remote Similarity	NPD4755	Approved
0.656	Remote Similarity	NPD7902	Approved
0.6557	Remote Similarity	NPD8034	Phase 2
0.6557	Remote Similarity	NPD8035	Phase 2
0.6547	Remote Similarity	NPD6067	Discontinued
0.6541	Remote Similarity	NPD6053	Discontinued
0.6535	Remote Similarity	NPD5344	Discontinued
0.6535	Remote Similarity	NPD1700	Approved
0.6519	Remote Similarity	NPD6274	Approved
0.6515	Remote Similarity	NPD6371	Approved
0.6512	Remote Similarity	NPD5141	Approved
0.6496	Remote Similarity	NPD7101	Approved
0.6496	Remote Similarity	NPD7100	Approved
0.6484	Remote Similarity	NPD5224	Approved
0.6484	Remote Similarity	NPD4633	Approved
0.6484	Remote Similarity	NPD5225	Approved
0.6484	Remote Similarity	NPD5226	Approved
0.6484	Remote Similarity	NPD7632	Discontinued
0.6457	Remote Similarity	NPD4700	Approved
0.6452	Remote Similarity	NPD7748	Approved
0.6434	Remote Similarity	NPD5174	Approved
0.6434	Remote Similarity	NPD5175	Approved
0.6429	Remote Similarity	NPD6083	Phase 2
0.6429	Remote Similarity	NPD6084	Phase 2
0.6423	Remote Similarity	NPD6335	Approved
0.6408	Remote Similarity	NPD8074	Phase 3
0.6407	Remote Similarity	NPD7799	Discontinued
0.6406	Remote Similarity	NPD5223	Approved
0.6378	Remote Similarity	NPD4225	Approved
0.6364	Remote Similarity	NPD4730	Approved
0.6364	Remote Similarity	NPD4729	Approved
0.635	Remote Similarity	NPD6317	Approved
0.6341	Remote Similarity	NPD46	Approved
0.6341	Remote Similarity	NPD6698	Approved
0.6336	Remote Similarity	NPD4768	Approved
0.6336	Remote Similarity	NPD4767	Approved
0.632	Remote Similarity	NPD7900	Approved
0.632	Remote Similarity	NPD7901	Clinical (unspecified phase)
0.6304	Remote Similarity	NPD6313	Approved
0.6304	Remote Similarity	NPD6314	Approved
0.6301	Remote Similarity	NPD8338	Approved
0.629	Remote Similarity	NPD6079	Approved
0.629	Remote Similarity	NPD7515	Phase 2
0.6288	Remote Similarity	NPD7899	Clinical (unspecified phase)
0.6286	Remote Similarity	NPD6908	Approved
0.6286	Remote Similarity	NPD6909	Approved
0.6286	Remote Similarity	NPD6291	Clinical (unspecified phase)
0.6277	Remote Similarity	NPD6940	Discontinued
0.627	Remote Similarity	NPD6356	Clinical (unspecified phase)
0.6269	Remote Similarity	NPD5251	Approved
0.6269	Remote Similarity	NPD5250	Approved
0.6269	Remote Similarity	NPD5248	Approved
0.6269	Remote Similarity	NPD5247	Approved
0.6269	Remote Similarity	NPD5249	Phase 3
0.626	Remote Similarity	NPD5328	Approved
0.625	Remote Similarity	NPD5696	Approved
0.625	Remote Similarity	NPD8029	Clinical (unspecified phase)
0.6241	Remote Similarity	NPD5128	Approved
0.624	Remote Similarity	NPD6399	Phase 3
0.624	Remote Similarity	NPD4202	Approved
0.6233	Remote Similarity	NPD7260	Phase 2
0.6202	Remote Similarity	NPD6648	Approved
0.6198	Remote Similarity	NPD7520	Clinical (unspecified phase)
0.6197	Remote Similarity	NPD7830	Approved
0.6197	Remote Similarity	NPD7829	Approved
0.6183	Remote Similarity	NPD4754	Approved
0.6179	Remote Similarity	NPD7513	Clinical (unspecified phase)
0.6154	Remote Similarity	NPD6115	Approved
0.6154	Remote Similarity	NPD6697	Approved
0.6154	Remote Similarity	NPD6118	Approved
0.6154	Remote Similarity	NPD6114	Approved
0.6142	Remote Similarity	NPD5695	Phase 3
0.6138	Remote Similarity	NPD8336	Approved
0.6138	Remote Similarity	NPD8337	Approved
0.6103	Remote Similarity	NPD5215	Approved
0.6103	Remote Similarity	NPD5216	Approved
0.6103	Remote Similarity	NPD5217	Approved
0.6094	Remote Similarity	NPD5222	Approved
0.6094	Remote Similarity	NPD4697	Phase 3
0.6094	Remote Similarity	NPD5221	Approved
0.6094	Remote Similarity	NPD5220	Clinical (unspecified phase)
0.6084	Remote Similarity	NPD7642	Approved
0.6068	Remote Similarity	NPD6116	Phase 1
0.6054	Remote Similarity	NPD5956	Approved
0.605	Remote Similarity	NPD6928	Phase 2
0.6047	Remote Similarity	NPD5173	Approved
0.6043	Remote Similarity	NPD6868	Approved
0.6033	Remote Similarity	NPD3669	Approved
0.6033	Remote Similarity	NPD4788	Approved
0.6033	Remote Similarity	NPD3670	Clinical (unspecified phase)
0.6032	Remote Similarity	NPD5693	Phase 1
0.6029	Remote Similarity	NPD5135	Approved
0.6029	Remote Similarity	NPD5134	Clinical (unspecified phase)
0.6029	Remote Similarity	NPD5169	Approved
0.6016	Remote Similarity	NPD5210	Approved
0.6016	Remote Similarity	NPD4629	Approved
0.6016	Remote Similarity	NPD7521	Approved
0.6016	Remote Similarity	NPD6409	Approved
0.6016	Remote Similarity	NPD7334	Approved
0.6016	Remote Similarity	NPD6684	Approved
0.6016	Remote Similarity	NPD3618	Phase 1
0.6016	Remote Similarity	NPD7146	Approved
0.6016	Remote Similarity	NPD5330	Approved
0.6013	Remote Similarity	NPD7236	Approved
0.6	Remote Similarity	NPD1779	Approved
0.6	Remote Similarity	NPD4753	Phase 2
0.6	Remote Similarity	NPD1780	Approved
0.5985	Remote Similarity	NPD5127	Approved
0.5983	Remote Similarity	NPD6117	Approved
0.5973	Remote Similarity	NPD6845	Suspended
0.5968	Remote Similarity	NPD3573	Approved
0.5952	Remote Similarity	NPD7838	Discovery

Structure

External Identifiers

PubChem CID
ChEMBL	CHEMBL3360247
ZINC

Physicochemical Properties

Molecular Weight:	750.42
ALogP:	-1.1294
MLogP:	4.43
XLogP:	2.405
# Rotatable Bonds:	22
Polar Surface Area:	171.97
# H-Bond Aceptor:	13
# H-Bond Donor:	3
# Rings:	7
# Heavy Atoms:	53

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