NPASS Natural Product

Natural Product: NPC315638

Natural Product ID:	NPC315638
Common Name:	Streptophenazine E
IUPAC Name:	methyl 6-(3-hydroxy-1-methoxy-1-oxoheptan-2-yl)phenazine-1-carboxylate
Synonyms:	Streptophenazine E
Molecular Formula:	C22H24N2O5
Standard InCHIKey:	IRNKVLMOMFBESJ-UHFFFAOYSA-N
Standard InCHI:	InChI=1S/C22H24N2O5/c1-4-5-12-17(25)18(22(27)29-3)13-8-6-10-15-19(13)23-16-11-7-9-14(20(16)24-15)21(26)28-2/h6-11,17-18,25H,4-5,12H2,1-3H3
Canonical SMILES:	CCCCC(C(c1cccc2c1nc1cccc(c1n2)C(=O)OC)C(=O)OC)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
NPO33655	Streptomyces sp. HB202	Species	Streptomycetaceae	Bacteria	obtained from the marine sponge Halichondria panicea	Baltic Sea, Germany		PMID[18396903]
NPO31702	Streptomyces hb202	Species	Streptomycetaceae	Bacteria				StreptomeDB*

Biological Activity

Activity Type	# Activity
Others	1

Activity Type	# Activity
Organism	1

Target ID	Target Type	Target Name	Target Organism	Activity Type	Activity Relation	Value	Unit	Reference
NPT79	Organism	Bacillus subtilis	Bacillus subtilis	Activity	=	62.5	ug/ml	18396903

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 NPC315638 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	235
0.1-0.2	1146
0.2-0.3	4553
0.3-0.4	9687
0.4-0.5	11551
0.5-0.6	2174
0.6-0.7	1288
0.7-0.8	236
0.8-0.85	3
0.85-0.9	9
0.9-0.95	0
0.95-1	7

Similarity Score	Similarity Level	Natural Product ID
1.0	High Similarity	NPC313796
1.0	High Similarity	NPC314855
1.0	High Similarity	NPC313345
0.9945	High Similarity	NPC314297
0.9945	High Similarity	NPC315545
0.9785	High Similarity	NPC314834
0.9728	High Similarity	NPC314648
0.8962	High Similarity	NPC90415
0.8798	High Similarity	NPC243058
0.875	High Similarity	NPC203635
0.8634	High Similarity	NPC256268
0.8593	High Similarity	NPC244856
0.8579	High Similarity	NPC219848
0.855	High Similarity	NPC236424
0.855	High Similarity	NPC306644
0.8507	High Similarity	NPC274842
0.8155	Intermediate Similarity	NPC312645
0.8128	Intermediate Similarity	NPC84347
0.8098	Intermediate Similarity	NPC89508
0.7926	Intermediate Similarity	NPC191310
0.7921	Intermediate Similarity	NPC165599
0.7892	Intermediate Similarity	NPC244741
0.7882	Intermediate Similarity	NPC132539
0.7873	Intermediate Similarity	NPC124300
0.7838	Intermediate Similarity	NPC291609
0.7833	Intermediate Similarity	NPC317572
0.7795	Intermediate Similarity	NPC194040
0.7768	Intermediate Similarity	NPC310618
0.7673	Intermediate Similarity	NPC474916
0.763	Intermediate Similarity	NPC477979
0.7624	Intermediate Similarity	NPC141454
0.7568	Intermediate Similarity	NPC57453
0.7525	Intermediate Similarity	NPC160381
0.7463	Intermediate Similarity	NPC280714
0.745	Intermediate Similarity	NPC175474
0.7443	Intermediate Similarity	NPC473506
0.744	Intermediate Similarity	NPC57398
0.7424	Intermediate Similarity	NPC471742
0.7424	Intermediate Similarity	NPC218388
0.7423	Intermediate Similarity	NPC303225
0.7415	Intermediate Similarity	NPC102008
0.7402	Intermediate Similarity	NPC472116
0.74	Intermediate Similarity	NPC472323
0.7397	Intermediate Similarity	NPC473850
0.7397	Intermediate Similarity	NPC475137
0.7397	Intermediate Similarity	NPC475498
0.7395	Intermediate Similarity	NPC227824
0.7387	Intermediate Similarity	NPC282103
0.7381	Intermediate Similarity	NPC243850
0.7376	Intermediate Similarity	NPC475644
0.7376	Intermediate Similarity	NPC471977
0.7376	Intermediate Similarity	NPC475362
0.7376	Intermediate Similarity	NPC470486
0.7376	Intermediate Similarity	NPC471190
0.7371	Intermediate Similarity	NPC118940
0.7358	Intermediate Similarity	NPC234999
0.7354	Intermediate Similarity	NPC30456
0.7352	Intermediate Similarity	NPC229893
0.7352	Intermediate Similarity	NPC250807
0.7352	Intermediate Similarity	NPC76565
0.7352	Intermediate Similarity	NPC57797
0.7351	Intermediate Similarity	NPC288445
0.7343	Intermediate Similarity	NPC79129
0.7343	Intermediate Similarity	NPC313985
0.7343	Intermediate Similarity	NPC49196
0.7343	Intermediate Similarity	NPC195461
0.7343	Intermediate Similarity	NPC81654
0.7343	Intermediate Similarity	NPC249150
0.734	Intermediate Similarity	NPC55493
0.7336	Intermediate Similarity	NPC317752
0.7333	Intermediate Similarity	NPC238457
0.733	Intermediate Similarity	NPC146824
0.733	Intermediate Similarity	NPC122968
0.733	Intermediate Similarity	NPC477787
0.733	Intermediate Similarity	NPC476110
0.733	Intermediate Similarity	NPC52557
0.733	Intermediate Similarity	NPC228377
0.733	Intermediate Similarity	NPC475600
0.733	Intermediate Similarity	NPC475631
0.733	Intermediate Similarity	NPC328186
0.733	Intermediate Similarity	NPC87152
0.7321	Intermediate Similarity	NPC237702
0.7317	Intermediate Similarity	NPC245916
0.7316	Intermediate Similarity	NPC27904
0.7309	Intermediate Similarity	NPC475303
0.7309	Intermediate Similarity	NPC292416
0.7309	Intermediate Similarity	NPC475596
0.7309	Intermediate Similarity	NPC473689
0.7309	Intermediate Similarity	NPC316841
0.7308	Intermediate Similarity	NPC471944
0.7306	Intermediate Similarity	NPC470894
0.7296	Intermediate Similarity	NPC471743
0.7295	Intermediate Similarity	NPC241024
0.729	Intermediate Similarity	NPC318299
0.7289	Intermediate Similarity	NPC327769
0.7289	Intermediate Similarity	NPC475406
0.7277	Intermediate Similarity	NPC196251
0.7277	Intermediate Similarity	NPC123839
0.7277	Intermediate Similarity	NPC102338
0.7277	Intermediate Similarity	NPC63199
0.7277	Intermediate Similarity	NPC244839
0.7277	Intermediate Similarity	NPC111602
0.7277	Intermediate Similarity	NPC319880
0.7277	Intermediate Similarity	NPC320324
0.7273	Intermediate Similarity	NPC15840
0.7269	Intermediate Similarity	NPC148183
0.7269	Intermediate Similarity	NPC152768
0.7269	Intermediate Similarity	NPC3207
0.7268	Intermediate Similarity	NPC19692
0.7268	Intermediate Similarity	NPC220151
0.7264	Intermediate Similarity	NPC39679
0.7264	Intermediate Similarity	NPC266249
0.7257	Intermediate Similarity	NPC38959
0.7257	Intermediate Similarity	NPC327904
0.7256	Intermediate Similarity	NPC250448
0.7256	Intermediate Similarity	NPC31700
0.7253	Intermediate Similarity	NPC473800
0.7251	Intermediate Similarity	NPC317373
0.725	Intermediate Similarity	NPC207851
0.725	Intermediate Similarity	NPC472119
0.7246	Intermediate Similarity	NPC50503
0.7243	Intermediate Similarity	NPC220337
0.7237	Intermediate Similarity	NPC253482
0.7236	Intermediate Similarity	NPC113626
0.7233	Intermediate Similarity	NPC102592
0.7233	Intermediate Similarity	NPC79356
0.7231	Intermediate Similarity	NPC249614
0.7228	Intermediate Similarity	NPC206186
0.7227	Intermediate Similarity	NPC477788
0.7225	Intermediate Similarity	NPC322644
0.7217	Intermediate Similarity	NPC475648
0.7215	Intermediate Similarity	NPC174760
0.7212	Intermediate Similarity	NPC35208
0.7212	Intermediate Similarity	NPC170751
0.7212	Intermediate Similarity	NPC123395
0.7212	Intermediate Similarity	NPC475426
0.7209	Intermediate Similarity	NPC472098
0.7209	Intermediate Similarity	NPC476467
0.7209	Intermediate Similarity	NPC475778
0.7206	Intermediate Similarity	NPC138370
0.7204	Intermediate Similarity	NPC289086
0.7204	Intermediate Similarity	NPC327592
0.7198	Intermediate Similarity	NPC107836
0.7192	Intermediate Similarity	NPC61435
0.7192	Intermediate Similarity	NPC183805
0.719	Intermediate Similarity	NPC162730
0.719	Intermediate Similarity	NPC328318
0.719	Intermediate Similarity	NPC474116
0.719	Intermediate Similarity	NPC328596
0.7189	Intermediate Similarity	NPC85702
0.7189	Intermediate Similarity	NPC477909
0.7189	Intermediate Similarity	NPC477907
0.7189	Intermediate Similarity	NPC42678
0.7183	Intermediate Similarity	NPC470280
0.7183	Intermediate Similarity	NPC63041
0.7177	Intermediate Similarity	NPC254240
0.7177	Intermediate Similarity	NPC312870
0.7177	Intermediate Similarity	NPC199851
0.7177	Intermediate Similarity	NPC214428
0.7177	Intermediate Similarity	NPC128265
0.7177	Intermediate Similarity	NPC294909
0.7163	Intermediate Similarity	NPC87413
0.7162	Intermediate Similarity	NPC477902
0.7156	Intermediate Similarity	NPC169402
0.7143	Intermediate Similarity	NPC470586
0.7143	Intermediate Similarity	NPC473815
0.7137	Intermediate Similarity	NPC165964
0.7136	Intermediate Similarity	NPC53344
0.7136	Intermediate Similarity	NPC323969
0.7136	Intermediate Similarity	NPC472099
0.7129	Intermediate Similarity	NPC79062
0.7129	Intermediate Similarity	NPC472107
0.7123	Intermediate Similarity	NPC82070
0.7123	Intermediate Similarity	NPC62367
0.7117	Intermediate Similarity	NPC471980
0.7116	Intermediate Similarity	NPC269367
0.7115	Intermediate Similarity	NPC474188
0.7114	Intermediate Similarity	NPC470317
0.711	Intermediate Similarity	NPC322064
0.7104	Intermediate Similarity	NPC60621
0.7101	Intermediate Similarity	NPC135950
0.7098	Intermediate Similarity	NPC211920
0.7098	Intermediate Similarity	NPC124029
0.7097	Intermediate Similarity	NPC234078
0.7097	Intermediate Similarity	NPC221100
0.7091	Intermediate Similarity	NPC84815
0.7091	Intermediate Similarity	NPC52254
0.7091	Intermediate Similarity	NPC216428
0.7091	Intermediate Similarity	NPC301368
0.7089	Intermediate Similarity	NPC309498
0.7089	Intermediate Similarity	NPC300156
0.7089	Intermediate Similarity	NPC277350
0.7085	Intermediate Similarity	NPC234987
0.708	Intermediate Similarity	NPC474701
0.7079	Intermediate Similarity	NPC320394
0.7079	Intermediate Similarity	NPC258480
0.7078	Intermediate Similarity	NPC475408
0.7078	Intermediate Similarity	NPC471014
0.7078	Intermediate Similarity	NPC471016
0.7077	Intermediate Similarity	NPC182131

Similar Clinical/Approved Drugs

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

● The left chart: Distribution of similarity level between NPC315638 and all drugs/candidates.
● The right table: Most similar clinical/approved drugs (Tc>=0.56 or Top200).

range	Tanimoto Coefficient
0-0.1	185
0.1-0.2	573
0.2-0.3	790
0.3-0.4	1332
0.4-0.5	2914
0.5-0.6	2415
0.6-0.7	856
0.7-0.8	95
0.8-0.85	1
0.85-0.9	0
0.9-0.95	0
0.95-1	0

Similarity Score	Similarity Level	Drug ID	Developmental Stage
0.8122	Intermediate Similarity	NPD4987	Clinical (unspecified phase)
0.7848	Intermediate Similarity	NPD5488	Discontinued
0.78	Intermediate Similarity	NPD5003	Discontinued
0.7729	Intermediate Similarity	NPD4506	Discontinued
0.7708	Intermediate Similarity	NPD6642	Approved
0.7708	Intermediate Similarity	NPD6641	Approved
0.7703	Intermediate Similarity	NPD6657	Clinical (unspecified phase)
0.7667	Intermediate Similarity	NPD3795	Approved
0.7667	Intermediate Similarity	NPD3794	Approved
0.7653	Intermediate Similarity	NPD6770	Approved
0.7608	Intermediate Similarity	NPD648	Clinical (unspecified phase)
0.7592	Intermediate Similarity	NPD6739	Clinical (unspecified phase)
0.7577	Intermediate Similarity	NPD5398	Clinical (unspecified phase)
0.7571	Intermediate Similarity	NPD6567	Clinical (unspecified phase)
0.7558	Intermediate Similarity	NPD3925	Approved
0.7523	Intermediate Similarity	NPD7878	Phase 2
0.75	Intermediate Similarity	NPD4901	Clinical (unspecified phase)
0.7465	Intermediate Similarity	NPD5417	Clinical (unspecified phase)
0.7463	Intermediate Similarity	NPD2336	Approved
0.7461	Intermediate Similarity	NPD43	Approved
0.7461	Intermediate Similarity	NPD6182	Approved
0.7461	Intermediate Similarity	NPD6183	Clinical (unspecified phase)
0.7438	Intermediate Similarity	NPD5975	Clinical (unspecified phase)
0.7435	Intermediate Similarity	NPD4554	Clinical (unspecified phase)
0.7429	Intermediate Similarity	NPD2510	Approved
0.7429	Intermediate Similarity	NPD2509	Approved
0.7415	Intermediate Similarity	NPD7778	Approved
0.7415	Intermediate Similarity	NPD7777	Approved
0.7415	Intermediate Similarity	NPD53	Approved
0.7413	Intermediate Similarity	NPD2565	Phase 2
0.7413	Intermediate Similarity	NPD2564	Approved
0.7406	Intermediate Similarity	NPD5416	Discontinued
0.74	Intermediate Similarity	NPD4948	Discontinued
0.7373	Intermediate Similarity	NPD3280	Approved
0.7368	Intermediate Similarity	NPD3947	Discontinued
0.7343	Intermediate Similarity	NPD4600	Approved
0.7343	Intermediate Similarity	NPD4601	Approved
0.7321	Intermediate Similarity	NPD2121	Clinical (unspecified phase)
0.7317	Intermediate Similarity	NPD2307	Discontinued
0.731	Intermediate Similarity	NPD8304	Clinical (unspecified phase)
0.7306	Intermediate Similarity	NPD6995	Phase 1
0.7289	Intermediate Similarity	NPD6142	Phase 3
0.7277	Intermediate Similarity	NPD4334	Discontinued
0.7277	Intermediate Similarity	NPD4900	Clinical (unspecified phase)
0.7269	Intermediate Similarity	NPD3389	Approved
0.7269	Intermediate Similarity	NPD3394	Approved
0.7269	Intermediate Similarity	NPD8160	Phase 2
0.7269	Intermediate Similarity	NPD4938	Phase 2
0.7269	Intermediate Similarity	NPD3393	Approved
0.7255	Intermediate Similarity	NPD4376	Phase 3
0.7252	Intermediate Similarity	NPD7268	Clinical (unspecified phase)
0.7249	Intermediate Similarity	NPD6716	Phase 1
0.7248	Intermediate Similarity	NPD3258	Approved
0.7243	Intermediate Similarity	NPD5475	Discontinued
0.7238	Intermediate Similarity	NPD2920	Discontinued
0.7233	Intermediate Similarity	NPD5512	Phase 3
0.7232	Intermediate Similarity	NPD6962	Phase 2
0.7204	Intermediate Similarity	NPD6987	Phase 1
0.719	Intermediate Similarity	NPD5721	Clinical (unspecified phase)
0.7177	Intermediate Similarity	NPD4500	Approved
0.7177	Intermediate Similarity	NPD4501	Approved
0.7169	Intermediate Similarity	NPD7404	Approved
0.7168	Intermediate Similarity	NPD4373	Phase 2
0.7163	Intermediate Similarity	NPD4397	Phase 1
0.7123	Intermediate Similarity	NPD6138	Clinical (unspecified phase)
0.7111	Intermediate Similarity	NPD5801	Clinical (unspecified phase)
0.7111	Intermediate Similarity	NPD4952	Phase 3
0.7105	Intermediate Similarity	NPD5891	Approved
0.7098	Intermediate Similarity	NPD6292	Clinical (unspecified phase)
0.7089	Intermediate Similarity	NPD6732	Clinical (unspecified phase)
0.7089	Intermediate Similarity	NPD5530	Phase 1
0.7087	Intermediate Similarity	NPD4315	Phase 2
0.708	Intermediate Similarity	NPD7688	Phase 1
0.7064	Intermediate Similarity	NPD5293	Phase 2
0.7064	Intermediate Similarity	NPD3257	Approved
0.7054	Intermediate Similarity	NPD8289	Discontinued
0.7048	Intermediate Similarity	NPD6999	Discontinued
0.7048	Intermediate Similarity	NPD7000	Clinical (unspecified phase)
0.7045	Intermediate Similarity	NPD7395	Discontinued
0.7042	Intermediate Similarity	NPD5901	Discontinued
0.7042	Intermediate Similarity	NPD6323	Clinical (unspecified phase)
0.7039	Intermediate Similarity	NPD5483	Clinical (unspecified phase)
0.7039	Intermediate Similarity	NPD7921	Approved
0.7026	Intermediate Similarity	NPD5821	Approved
0.7022	Intermediate Similarity	NPD3259	Approved
0.7022	Intermediate Similarity	NPD4328	Approved
0.7021	Intermediate Similarity	NPD7398	Approved
0.7021	Intermediate Similarity	NPD7397	Approved
0.7015	Intermediate Similarity	NPD5899	Approved
0.7015	Intermediate Similarity	NPD5898	Approved
0.7015	Intermediate Similarity	NPD5897	Approved
0.7013	Intermediate Similarity	NPD2921	Clinical (unspecified phase)
0.7009	Intermediate Similarity	NPD7010	Phase 3
0.7009	Intermediate Similarity	NPD7001	Phase 3
0.7005	Intermediate Similarity	NPD4950	Approved
0.7	Intermediate Similarity	NPD2882	Phase 1
0.6996	Remote Similarity	NPD6160	Clinical (unspecified phase)
0.6995	Remote Similarity	NPD6176	Phase 1
0.6995	Remote Similarity	NPD3436	Approved
0.6991	Remote Similarity	NPD6529	Discontinued
0.6986	Remote Similarity	NPD7538	Clinical (unspecified phase)
0.6983	Remote Similarity	NPD6790	Phase 1
0.6983	Remote Similarity	NPD7417	Discontinued
0.6981	Remote Similarity	NPD7727	Phase 2
0.6977	Remote Similarity	NPD5429	Discontinued
0.6975	Remote Similarity	NPD8463	Approved
0.697	Remote Similarity	NPD3776	Discontinued
0.6967	Remote Similarity	NPD6661	Clinical (unspecified phase)
0.6961	Remote Similarity	NPD6227	Discontinued
0.6957	Remote Similarity	NPD3785	Clinical (unspecified phase)
0.6954	Remote Similarity	NPD2844	Phase 3
0.6953	Remote Similarity	NPD7770	Phase 3
0.6943	Remote Similarity	NPD4671	Clinical (unspecified phase)
0.6943	Remote Similarity	NPD4669	Clinical (unspecified phase)
0.6943	Remote Similarity	NPD4670	Clinical (unspecified phase)
0.6941	Remote Similarity	NPD7571	Clinical (unspecified phase)
0.6938	Remote Similarity	NPD4602	Approved
0.6927	Remote Similarity	NPD4417	Approved
0.6927	Remote Similarity	NPD7703	Clinical (unspecified phase)
0.692	Remote Similarity	NPD6824	Clinical (unspecified phase)
0.692	Remote Similarity	NPD5482	Discontinued
0.6919	Remote Similarity	NPD1573	Approved
0.6919	Remote Similarity	NPD7946	Pre-registration
0.6919	Remote Similarity	NPD1575	Approved
0.6911	Remote Similarity	NPD6158	Phase 2
0.6911	Remote Similarity	NPD6476	Clinical (unspecified phase)
0.6909	Remote Similarity	NPD4897	Phase 2
0.6901	Remote Similarity	NPD7817	Phase 1
0.69	Remote Similarity	NPD6492	Phase 2
0.6897	Remote Similarity	NPD7867	Phase 1
0.6897	Remote Similarity	NPD4204	Approved
0.6897	Remote Similarity	NPD3435	Discontinued
0.6897	Remote Similarity	NPD4203	Approved
0.6895	Remote Similarity	NPD2737	Clinical (unspecified phase)
0.6892	Remote Similarity	NPD5632	Approved
0.6888	Remote Similarity	NPD1631	Approved
0.6888	Remote Similarity	NPD7776	Approved
0.6884	Remote Similarity	NPD8114	Approved
0.6884	Remote Similarity	NPD7712	Clinical (unspecified phase)
0.6884	Remote Similarity	NPD485	Clinical (unspecified phase)
0.6884	Remote Similarity	NPD8115	Approved
0.6878	Remote Similarity	NPD8102	Discontinued
0.6875	Remote Similarity	NPD5506	Approved
0.6875	Remote Similarity	NPD5507	Approved
0.6872	Remote Similarity	NPD6206	Phase 1
0.6866	Remote Similarity	NPD7665	Phase 2
0.6866	Remote Similarity	NPD7666	Phase 3
0.6854	Remote Similarity	NPD6479	Discontinued
0.6854	Remote Similarity	NPD8248	Clinical (unspecified phase)
0.6849	Remote Similarity	NPD7070	Clinical (unspecified phase)
0.6849	Remote Similarity	NPD7470	Discontinued
0.6845	Remote Similarity	NPD5444	Phase 1
0.6842	Remote Similarity	NPD7569	Approved
0.6842	Remote Similarity	NPD7570	Approved
0.684	Remote Similarity	NPD6261	Phase 3
0.6835	Remote Similarity	NPD7941	Phase 3
0.6835	Remote Similarity	NPD5583	Clinical (unspecified phase)
0.6832	Remote Similarity	NPD3755	Clinical (unspecified phase)
0.6831	Remote Similarity	NPD7708	Approved
0.683	Remote Similarity	NPD8479	Phase 2
0.6829	Remote Similarity	NPD721	Approved
0.6827	Remote Similarity	NPD3321	Discontinued
0.6827	Remote Similarity	NPD4499	Approved
0.6827	Remote Similarity	NPD8063	Discontinued
0.6825	Remote Similarity	NPD6550	Discontinued
0.6825	Remote Similarity	NPD6722	Clinical (unspecified phase)
0.6818	Remote Similarity	NPD5866	Approved
0.6818	Remote Similarity	NPD7069	Discontinued
0.6818	Remote Similarity	NPD8096	Phase 3
0.6818	Remote Similarity	NPD8097	Phase 3
0.6816	Remote Similarity	NPD4429	Discontinued
0.6816	Remote Similarity	NPD4736	Clinical (unspecified phase)
0.6812	Remote Similarity	NPD5022	Discontinued
0.6808	Remote Similarity	NPD6249	Phase 2
0.6808	Remote Similarity	NPD6248	Phase 2
0.6806	Remote Similarity	NPD7103	Approved
0.6804	Remote Similarity	NPD2836	Approved
0.6802	Remote Similarity	NPD6733	Discontinued
0.68	Remote Similarity	NPD4301	Approved
0.6797	Remote Similarity	NPD6741	Clinical (unspecified phase)
0.6794	Remote Similarity	NPD5592	Clinical (unspecified phase)
0.6793	Remote Similarity	NPD5807	Phase 2
0.6793	Remote Similarity	NPD8468	Phase 2
0.6789	Remote Similarity	NPD7803	Approved
0.6787	Remote Similarity	NPD3243	Approved
0.6779	Remote Similarity	NPD1534	Approved
0.6774	Remote Similarity	NPD6245	Phase 2
0.6774	Remote Similarity	NPD4862	Clinical (unspecified phase)
0.6773	Remote Similarity	NPD7927	Clinical (unspecified phase)
0.6769	Remote Similarity	NPD7767	Approved
0.6769	Remote Similarity	NPD820	Phase 3
0.6765	Remote Similarity	NPD1643	Phase 3
0.6765	Remote Similarity	NPD7996	Phase 2
0.6763	Remote Similarity	NPD3315	Phase 3
0.6762	Remote Similarity	NPD6228	Discontinued
0.6756	Remote Similarity	NPD5827	Discontinued
0.6754	Remote Similarity	NPD7426	Phase 1
0.6753	Remote Similarity	NPD6263	Clinical (unspecified phase)
0.6753	Remote Similarity	NPD5257	Clinical (unspecified phase)
0.6748	Remote Similarity	NPD5083	Clinical (unspecified phase)

Structure

CID315638 OpenBabel06191716132D 29 31 0 0 1 0 0 0 0 0999 V2000 5.1962 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5981 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -5.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3301 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4641 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5981 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5981 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7321 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7321 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4641 -3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7321 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7321 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8660 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -3.5000 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7321 -3.0000 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8660 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8660 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7321 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 -3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -2.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0000 -0.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -4.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8660 1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -3.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5981 1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 -4.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 4 1 0 0 0 0 2 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 5 12 1 0 0 0 0 6 8 2 0 0 0 0 6 10 1 0 0 0 0 7 9 1 0 0 0 0 7 11 2 0 0 0 0 8 13 1 0 0 0 0 9 14 2 0 0 0 0 10 15 2 0 0 0 0 11 16 1 0 0 0 0 12 17 1 0 0 0 0 13 18 1 0 0 0 0 13 19 2 0 0 0 0 14 20 1 0 0 0 0 14 21 1 0 0 0 0 15 19 1 0 0 0 0 15 24 1 0 0 0 0 16 20 1 0 0 0 0 16 23 2 0 0 0 0 17 18 1 0 0 0 0 17 25 1 0 0 0 0 18 22 1 0 0 0 0 19 23 1 0 0 0 0 20 24 2 0 0 0 0 21 26 2 0 0 0 0 21 28 1 0 0 0 0 22 27 2 0 0 0 0 22 29 1 0 0 0 0 M END $$$$

External Identifiers

PubChem CID	24879216
ChEMBL	CHEMBL522554
ZINC

Physicochemical Properties

Molecular Weight:	396.17
ALogP:	-1.4457
MLogP:	3.11
XLogP:	3.833
# Rotatable Bonds:	13
Polar Surface Area:	98.61
# H-Bond Aceptor:	7
# H-Bond Donor:	1
# Rings:	3
# Heavy Atoms:	29

Download Data

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