NPASS Natural Product

Natural Product: NPC477215

Natural Product ID:	NPC477215
Common Name:	Halorosellinic Acid
IUPAC Name:
Synonyms:	Halorosellinic Acid
Molecular Formula:	C25H36O6
Standard InCHIKey:	XHFDLHDZJBWKEA-VAHPCMBTSA-N
Standard InCHI:	InChI=1S/C25H36O6/c1-13-5-6-17-18(24(30)31)7-8-20-16(9-10-25(20,4)12-19(13)17)15(3)22(27)21(26)11-14(2)23(28)29/h7,9,11,13,15,17,19-22,26-27H,5-6,8,10,12H2,1-4H3,(H,28,29)(H,30,31)/b14-11+,18-7+/t13-,15+,17-,19-,20-,21-,22-,25+/m1/s1
Canonical SMILES:	O[C@@H]([C@@H]([C@H](C1=CC[C@@]2([C@@H]1CC=C(C(=O)O)[C@@H]1[C@H](C2)[C@H](C)CC1)C)C)O)/C=C(/C(=O)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
NPO6003	Halorosellinia oceanica	Species	Xylariaceae	Eukaryota				PMID[19299148]

Biological Activity

Activity Type	# Activity
IC50	1

Activity Type	# Activity
Organism	1

Target ID	Target Type	Target Name	Target Organism	Activity Type	Activity Relation	Value	Unit	Reference
NPT6	Organism	Plasmodium falciparum	Plasmodium falciparum	IC50	=	13	ug/ml	19299148

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 NPC477215 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	122
0.1-0.2	712
0.2-0.3	3114
0.3-0.4	8929
0.4-0.5	7771
0.5-0.6	4680
0.6-0.7	4569
0.7-0.8	983
0.8-0.85	7
0.85-0.9	1
0.9-0.95	0
0.95-1	1

Similarity Score	Similarity Level	Natural Product ID
1.0	High Similarity	NPC476388
0.871	High Similarity	NPC471610
0.8242	Intermediate Similarity	NPC232747
0.8235	Intermediate Similarity	NPC192006
0.8191	Intermediate Similarity	NPC472469
0.8085	Intermediate Similarity	NPC90453
0.8043	Intermediate Similarity	NPC214387
0.8	Intermediate Similarity	NPC279537
0.8	Intermediate Similarity	NPC476174
0.7979	Intermediate Similarity	NPC37816
0.7979	Intermediate Similarity	NPC474736
0.7978	Intermediate Similarity	NPC65350
0.7957	Intermediate Similarity	NPC477711
0.7957	Intermediate Similarity	NPC477147
0.7957	Intermediate Similarity	NPC477149
0.7938	Intermediate Similarity	NPC166745
0.7938	Intermediate Similarity	NPC235464
0.7938	Intermediate Similarity	NPC197386
0.7935	Intermediate Similarity	NPC472870
0.7917	Intermediate Similarity	NPC472941
0.7917	Intermediate Similarity	NPC456
0.7912	Intermediate Similarity	NPC472869
0.7907	Intermediate Similarity	NPC86917
0.7889	Intermediate Similarity	NPC472864
0.7889	Intermediate Similarity	NPC165064
0.7889	Intermediate Similarity	NPC472865
0.7889	Intermediate Similarity	NPC19849
0.7889	Intermediate Similarity	NPC164577
0.7865	Intermediate Similarity	NPC256750
0.7865	Intermediate Similarity	NPC20262
0.7849	Intermediate Similarity	NPC123912
0.7849	Intermediate Similarity	NPC310236
0.7849	Intermediate Similarity	NPC170775
0.7826	Intermediate Similarity	NPC237540
0.7812	Intermediate Similarity	NPC174948
0.7812	Intermediate Similarity	NPC173875
0.7812	Intermediate Similarity	NPC318282
0.7812	Intermediate Similarity	NPC469995
0.7791	Intermediate Similarity	NPC469646
0.7778	Intermediate Similarity	NPC97913
0.7766	Intermediate Similarity	NPC473448
0.7755	Intermediate Similarity	NPC471717
0.7753	Intermediate Similarity	NPC88735
0.7742	Intermediate Similarity	NPC104560
0.7742	Intermediate Similarity	NPC117122
0.7742	Intermediate Similarity	NPC193843
0.7742	Intermediate Similarity	NPC477710
0.7742	Intermediate Similarity	NPC249889
0.7732	Intermediate Similarity	NPC29152
0.7732	Intermediate Similarity	NPC117133
0.7732	Intermediate Similarity	NPC471463
0.7732	Intermediate Similarity	NPC301534
0.7732	Intermediate Similarity	NPC250757
0.7732	Intermediate Similarity	NPC328371
0.7727	Intermediate Similarity	NPC301769
0.7717	Intermediate Similarity	NPC186975
0.7708	Intermediate Similarity	NPC65829
0.7708	Intermediate Similarity	NPC53685
0.77	Intermediate Similarity	NPC86077
0.77	Intermediate Similarity	NPC25639
0.77	Intermediate Similarity	NPC118405
0.7692	Intermediate Similarity	NPC472326
0.7692	Intermediate Similarity	NPC82297
0.7684	Intermediate Similarity	NPC476187
0.7684	Intermediate Similarity	NPC470113
0.7677	Intermediate Similarity	NPC470074
0.7677	Intermediate Similarity	NPC241221
0.7677	Intermediate Similarity	NPC476274
0.7677	Intermediate Similarity	NPC287833
0.7674	Intermediate Similarity	NPC474011
0.767	Intermediate Similarity	NPC220155
0.7667	Intermediate Similarity	NPC7414
0.766	Intermediate Similarity	NPC212664
0.766	Intermediate Similarity	NPC66344
0.766	Intermediate Similarity	NPC146554
0.766	Intermediate Similarity	NPC268298
0.7653	Intermediate Similarity	NPC320306
0.7653	Intermediate Similarity	NPC469432
0.7653	Intermediate Similarity	NPC253826
0.7653	Intermediate Similarity	NPC156546
0.7634	Intermediate Similarity	NPC312561
0.7634	Intermediate Similarity	NPC236618
0.7634	Intermediate Similarity	NPC128644
0.7629	Intermediate Similarity	NPC476488
0.7629	Intermediate Similarity	NPC476487
0.7624	Intermediate Similarity	NPC475050
0.7624	Intermediate Similarity	NPC476237
0.7614	Intermediate Similarity	NPC475994
0.7609	Intermediate Similarity	NPC179006
0.7609	Intermediate Similarity	NPC474853
0.7609	Intermediate Similarity	NPC269638
0.7609	Intermediate Similarity	NPC137033
0.7604	Intermediate Similarity	NPC109305
0.7604	Intermediate Similarity	NPC472871
0.76	Intermediate Similarity	NPC146822
0.76	Intermediate Similarity	NPC472924
0.76	Intermediate Similarity	NPC99411
0.76	Intermediate Similarity	NPC476223
0.76	Intermediate Similarity	NPC476240
0.76	Intermediate Similarity	NPC118174
0.76	Intermediate Similarity	NPC224720
0.76	Intermediate Similarity	NPC150923
0.7582	Intermediate Similarity	NPC108045
0.7582	Intermediate Similarity	NPC475622
0.7579	Intermediate Similarity	NPC281942
0.7579	Intermediate Similarity	NPC129419
0.7579	Intermediate Similarity	NPC472466
0.7579	Intermediate Similarity	NPC472866
0.7579	Intermediate Similarity	NPC48010
0.7579	Intermediate Similarity	NPC474761
0.7579	Intermediate Similarity	NPC145666
0.7579	Intermediate Similarity	NPC476004
0.7579	Intermediate Similarity	NPC232426
0.7579	Intermediate Similarity	NPC469368
0.7576	Intermediate Similarity	NPC141191
0.7576	Intermediate Similarity	NPC98868
0.7556	Intermediate Similarity	NPC47031
0.7556	Intermediate Similarity	NPC325031
0.7529	Intermediate Similarity	NPC67076
0.7529	Intermediate Similarity	NPC319163
0.7528	Intermediate Similarity	NPC181195
0.7528	Intermediate Similarity	NPC261125
0.7528	Intermediate Similarity	NPC32758
0.7527	Intermediate Similarity	NPC475007
0.7527	Intermediate Similarity	NPC305475
0.7527	Intermediate Similarity	NPC475461
0.7527	Intermediate Similarity	NPC155011
0.7526	Intermediate Similarity	NPC167219
0.7526	Intermediate Similarity	NPC477131
0.7526	Intermediate Similarity	NPC476186
0.7526	Intermediate Similarity	NPC469406
0.7525	Intermediate Similarity	NPC195290
0.7525	Intermediate Similarity	NPC293753
0.7525	Intermediate Similarity	NPC204450
0.7525	Intermediate Similarity	NPC473424
0.7524	Intermediate Similarity	NPC29133
0.7524	Intermediate Similarity	NPC37116
0.75	Intermediate Similarity	NPC472468
0.75	Intermediate Similarity	NPC201406
0.75	Intermediate Similarity	NPC189520
0.75	Intermediate Similarity	NPC7927
0.75	Intermediate Similarity	NPC276769
0.75	Intermediate Similarity	NPC238197
0.75	Intermediate Similarity	NPC472014
0.75	Intermediate Similarity	NPC266955
0.75	Intermediate Similarity	NPC327431
0.75	Intermediate Similarity	NPC141831
0.75	Intermediate Similarity	NPC45269
0.75	Intermediate Similarity	NPC476038
0.75	Intermediate Similarity	NPC248758
0.75	Intermediate Similarity	NPC290651
0.75	Intermediate Similarity	NPC230527
0.75	Intermediate Similarity	NPC221282
0.75	Intermediate Similarity	NPC473986
0.75	Intermediate Similarity	NPC474018
0.75	Intermediate Similarity	NPC51370
0.75	Intermediate Similarity	NPC165287
0.75	Intermediate Similarity	NPC473998
0.75	Intermediate Similarity	NPC194937
0.7476	Intermediate Similarity	NPC323834
0.7476	Intermediate Similarity	NPC243998
0.7475	Intermediate Similarity	NPC475894
0.7475	Intermediate Similarity	NPC202705
0.7475	Intermediate Similarity	NPC474785
0.7475	Intermediate Similarity	NPC477949
0.7475	Intermediate Similarity	NPC169205
0.7475	Intermediate Similarity	NPC108078
0.7475	Intermediate Similarity	NPC474938
0.7474	Intermediate Similarity	NPC262043
0.7474	Intermediate Similarity	NPC473999
0.7474	Intermediate Similarity	NPC472240
0.7474	Intermediate Similarity	NPC262858
0.7474	Intermediate Similarity	NPC295312
0.7474	Intermediate Similarity	NPC309603
0.7474	Intermediate Similarity	NPC155479
0.7473	Intermediate Similarity	NPC35556
0.7473	Intermediate Similarity	NPC474291
0.7453	Intermediate Similarity	NPC470961
0.7451	Intermediate Similarity	NPC112009
0.7451	Intermediate Similarity	NPC236390
0.7449	Intermediate Similarity	NPC304886
0.7449	Intermediate Similarity	NPC472932
0.7449	Intermediate Similarity	NPC293052
0.7447	Intermediate Similarity	NPC136948
0.7447	Intermediate Similarity	NPC287079
0.7447	Intermediate Similarity	NPC312215
0.7447	Intermediate Similarity	NPC167877
0.7444	Intermediate Similarity	NPC115418
0.7444	Intermediate Similarity	NPC271104
0.7444	Intermediate Similarity	NPC45495
0.7429	Intermediate Similarity	NPC47951
0.7426	Intermediate Similarity	NPC303559
0.7426	Intermediate Similarity	NPC282524
0.7426	Intermediate Similarity	NPC115899
0.7426	Intermediate Similarity	NPC163372
0.7426	Intermediate Similarity	NPC302537
0.7423	Intermediate Similarity	NPC469692
0.7423	Intermediate Similarity	NPC125180
0.7423	Intermediate Similarity	NPC472930
0.7423	Intermediate Similarity	NPC476304

Similar Clinical/Approved Drugs

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

● The left chart: Distribution of similarity level between NPC477215 and all drugs/candidates.
● The right table: Most similar clinical/approved drugs (Tc>=0.56 or Top200).

range	Tanimoto Coefficient
0-0.1	134
0.1-0.2	1379
0.2-0.3	3690
0.3-0.4	2695
0.4-0.5	741
0.5-0.6	240
0.6-0.7	251
0.7-0.8	28
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
0.8391	Intermediate Similarity	NPD5362	Discontinued
0.8235	Intermediate Similarity	NPD5784	Clinical (unspecified phase)
0.8	Intermediate Similarity	NPD5363	Approved
0.7957	Intermediate Similarity	NPD5785	Approved
0.7778	Intermediate Similarity	NPD5332	Approved
0.7778	Intermediate Similarity	NPD5331	Approved
0.7753	Intermediate Similarity	NPD4790	Discontinued
0.7667	Intermediate Similarity	NPD4269	Approved
0.7667	Intermediate Similarity	NPD4270	Approved
0.7582	Intermediate Similarity	NPD7154	Phase 3
0.7444	Intermediate Similarity	NPD4252	Approved
0.7444	Intermediate Similarity	NPD4821	Approved
0.7444	Intermediate Similarity	NPD4822	Approved
0.7444	Intermediate Similarity	NPD4820	Approved
0.7444	Intermediate Similarity	NPD4819	Approved
0.7416	Intermediate Similarity	NPD4271	Approved
0.7416	Intermediate Similarity	NPD4268	Approved
0.7358	Intermediate Similarity	NPD6371	Approved
0.734	Intermediate Similarity	NPD5786	Approved
0.7273	Intermediate Similarity	NPD1698	Clinical (unspecified phase)
0.7253	Intermediate Similarity	NPD5790	Clinical (unspecified phase)
0.7174	Intermediate Similarity	NPD5369	Approved
0.7128	Intermediate Similarity	NPD4786	Approved
0.7117	Intermediate Similarity	NPD7115	Discovery
0.7075	Intermediate Similarity	NPD7899	Clinical (unspecified phase)
0.7071	Intermediate Similarity	NPD6399	Phase 3
0.7065	Intermediate Similarity	NPD5368	Approved
0.7059	Intermediate Similarity	NPD4225	Approved
0.7053	Intermediate Similarity	NPD6082	Clinical (unspecified phase)
0.7041	Intermediate Similarity	NPD6698	Approved
0.7041	Intermediate Similarity	NPD46	Approved
0.699	Remote Similarity	NPD7639	Approved
0.699	Remote Similarity	NPD7640	Approved
0.6979	Remote Similarity	NPD5279	Phase 3
0.697	Remote Similarity	NPD6079	Approved
0.697	Remote Similarity	NPD7637	Suspended
0.6961	Remote Similarity	NPD6084	Phase 2
0.6961	Remote Similarity	NPD6083	Phase 2
0.6947	Remote Similarity	NPD3133	Approved
0.6947	Remote Similarity	NPD3665	Phase 1
0.6947	Remote Similarity	NPD3666	Approved
0.6939	Remote Similarity	NPD5328	Approved
0.6915	Remote Similarity	NPD4752	Clinical (unspecified phase)
0.6915	Remote Similarity	NPD3667	Approved
0.6915	Remote Similarity	NPD6435	Approved
0.6907	Remote Similarity	NPD4250	Approved
0.6907	Remote Similarity	NPD4251	Approved
0.6893	Remote Similarity	NPD7638	Approved
0.6852	Remote Similarity	NPD6686	Approved
0.6837	Remote Similarity	NPD6903	Approved
0.6837	Remote Similarity	NPD6672	Approved
0.6837	Remote Similarity	NPD5737	Approved
0.6813	Remote Similarity	NPD6933	Approved
0.6804	Remote Similarity	NPD7521	Approved
0.6804	Remote Similarity	NPD4249	Approved
0.6804	Remote Similarity	NPD5330	Approved
0.6804	Remote Similarity	NPD3618	Phase 1
0.6804	Remote Similarity	NPD7334	Approved
0.6804	Remote Similarity	NPD6684	Approved
0.6804	Remote Similarity	NPD7146	Approved
0.6804	Remote Similarity	NPD6409	Approved
0.68	Remote Similarity	NPD7515	Phase 2
0.68	Remote Similarity	NPD7983	Approved
0.6768	Remote Similarity	NPD4753	Phase 2
0.6765	Remote Similarity	NPD5695	Phase 3
0.6733	Remote Similarity	NPD5778	Approved
0.6733	Remote Similarity	NPD5779	Approved
0.6701	Remote Similarity	NPD7520	Clinical (unspecified phase)
0.67	Remote Similarity	NPD7838	Discovery
0.6699	Remote Similarity	NPD5220	Clinical (unspecified phase)
0.6699	Remote Similarity	NPD5222	Approved
0.6699	Remote Similarity	NPD5221	Approved
0.6698	Remote Similarity	NPD5211	Phase 2
0.6697	Remote Similarity	NPD7320	Approved
0.6697	Remote Similarity	NPD6881	Approved
0.6697	Remote Similarity	NPD6899	Approved
0.6667	Remote Similarity	NPD5739	Approved
0.6667	Remote Similarity	NPD7513	Clinical (unspecified phase)
0.6667	Remote Similarity	NPD6404	Discontinued
0.6667	Remote Similarity	NPD6675	Approved
0.6667	Remote Similarity	NPD6402	Approved
0.6667	Remote Similarity	NPD7128	Approved
0.6635	Remote Similarity	NPD5173	Approved
0.6634	Remote Similarity	NPD6411	Approved
0.6634	Remote Similarity	NPD5284	Approved
0.6634	Remote Similarity	NPD5281	Approved
0.6607	Remote Similarity	NPD8297	Approved
0.6607	Remote Similarity	NPD6053	Discontinued
0.6606	Remote Similarity	NPD5697	Approved
0.6602	Remote Similarity	NPD5210	Approved
0.6602	Remote Similarity	NPD4629	Approved
0.66	Remote Similarity	NPD1695	Approved
0.6596	Remote Similarity	NPD6929	Approved
0.6593	Remote Similarity	NPD6926	Approved
0.6593	Remote Similarity	NPD6924	Approved
0.6577	Remote Similarity	NPD7290	Approved
0.6577	Remote Similarity	NPD7102	Approved
0.6577	Remote Similarity	NPD6883	Approved
0.6574	Remote Similarity	NPD5141	Approved
0.6571	Remote Similarity	NPD5696	Approved
0.6569	Remote Similarity	NPD4202	Approved
0.6566	Remote Similarity	NPD7524	Approved
0.6562	Remote Similarity	NPD4800	Clinical (unspecified phase)
0.6562	Remote Similarity	NPD4223	Phase 3
0.6562	Remote Similarity	NPD4221	Approved
0.6562	Remote Similarity	NPD5209	Approved
0.6549	Remote Similarity	NPD4632	Approved
0.6545	Remote Similarity	NPD6011	Approved
0.6538	Remote Similarity	NPD4697	Phase 3
0.6531	Remote Similarity	NPD1694	Approved
0.6531	Remote Similarity	NPD5329	Approved
0.6526	Remote Similarity	NPD4695	Discontinued
0.6526	Remote Similarity	NPD6931	Approved
0.6526	Remote Similarity	NPD6930	Phase 2
0.6518	Remote Similarity	NPD6649	Approved
0.6518	Remote Similarity	NPD6847	Approved
0.6518	Remote Similarity	NPD6650	Approved
0.6518	Remote Similarity	NPD8130	Phase 1
0.6518	Remote Similarity	NPD6617	Approved
0.6518	Remote Similarity	NPD6869	Approved
0.6512	Remote Similarity	NPD3197	Phase 1
0.6509	Remote Similarity	NPD4696	Approved
0.6509	Remote Similarity	NPD5286	Approved
0.6509	Remote Similarity	NPD5285	Approved
0.6505	Remote Similarity	NPD7748	Approved
0.6505	Remote Similarity	NPD5282	Discontinued
0.6495	Remote Similarity	NPD6695	Phase 3
0.6495	Remote Similarity	NPD4788	Approved
0.6489	Remote Similarity	NPD7322	Clinical (unspecified phase)
0.6486	Remote Similarity	NPD6014	Approved
0.6486	Remote Similarity	NPD6373	Approved
0.6486	Remote Similarity	NPD6013	Approved
0.6486	Remote Similarity	NPD6012	Approved
0.6486	Remote Similarity	NPD6372	Approved
0.6476	Remote Similarity	NPD4755	Approved
0.6465	Remote Similarity	NPD5690	Phase 2
0.6465	Remote Similarity	NPD4623	Approved
0.6465	Remote Similarity	NPD4519	Discontinued
0.646	Remote Similarity	NPD6882	Approved
0.6455	Remote Similarity	NPD6412	Phase 2
0.6455	Remote Similarity	NPD5701	Approved
0.6449	Remote Similarity	NPD5223	Approved
0.6442	Remote Similarity	NPD6356	Clinical (unspecified phase)
0.6436	Remote Similarity	NPD5764	Clinical (unspecified phase)
0.6436	Remote Similarity	NPD6101	Approved
0.6436	Remote Similarity	NPD6673	Approved
0.6436	Remote Similarity	NPD5370	Suspended
0.6436	Remote Similarity	NPD6904	Approved
0.6436	Remote Similarity	NPD6080	Approved
0.6429	Remote Similarity	NPD7338	Clinical (unspecified phase)
0.6429	Remote Similarity	NPD3668	Phase 3
0.6429	Remote Similarity	NPD4197	Approved
0.6429	Remote Similarity	NPD6400	Clinical (unspecified phase)
0.6429	Remote Similarity	NPD5766	Clinical (unspecified phase)
0.6389	Remote Similarity	NPD5226	Approved
0.6389	Remote Similarity	NPD7632	Discontinued
0.6389	Remote Similarity	NPD4633	Approved
0.6389	Remote Similarity	NPD5225	Approved
0.6389	Remote Similarity	NPD5224	Approved
0.6383	Remote Similarity	NPD5776	Phase 2
0.6383	Remote Similarity	NPD6925	Approved
0.6383	Remote Similarity	NPD4756	Discovery
0.6372	Remote Similarity	NPD6401	Clinical (unspecified phase)
0.6364	Remote Similarity	NPD1696	Phase 3
0.6364	Remote Similarity	NPD7507	Approved
0.6355	Remote Similarity	NPD4700	Approved
0.6354	Remote Similarity	NPD7514	Phase 3
0.6354	Remote Similarity	NPD7332	Phase 2
0.6344	Remote Similarity	NPD7339	Approved
0.6344	Remote Similarity	NPD6942	Approved
0.6337	Remote Similarity	NPD4518	Approved
0.6333	Remote Similarity	NPD6923	Approved
0.6333	Remote Similarity	NPD6922	Approved
0.633	Remote Similarity	NPD5174	Approved
0.633	Remote Similarity	NPD5175	Approved
0.6321	Remote Similarity	NPD7902	Approved
0.6316	Remote Similarity	NPD7145	Approved
0.6311	Remote Similarity	NPD4810	Clinical (unspecified phase)
0.6311	Remote Similarity	NPD8034	Phase 2
0.6311	Remote Similarity	NPD5693	Phase 1
0.6311	Remote Similarity	NPD6050	Approved
0.6311	Remote Similarity	NPD8035	Phase 2
0.63	Remote Similarity	NPD3574	Clinical (unspecified phase)
0.63	Remote Similarity	NPD4689	Approved
0.63	Remote Similarity	NPD5280	Approved
0.63	Remote Similarity	NPD4694	Approved
0.63	Remote Similarity	NPD4693	Phase 3
0.63	Remote Similarity	NPD5205	Approved
0.63	Remote Similarity	NPD4688	Approved
0.63	Remote Similarity	NPD4138	Approved
0.63	Remote Similarity	NPD4690	Approved
0.6296	Remote Similarity	NPD5344	Discontinued
0.6293	Remote Similarity	NPD6868	Approved
0.6289	Remote Similarity	NPD857	Phase 3
0.6289	Remote Similarity	NPD6902	Approved
0.6283	Remote Similarity	NPD6420	Discontinued
0.6283	Remote Similarity	NPD4634	Approved
0.6275	Remote Similarity	NPD7285	Clinical (unspecified phase)
0.6264	Remote Similarity	NPD7144	Approved
0.6264	Remote Similarity	NPD7143	Approved

Structure

External Identifiers

PubChem CID	49798939
ChEMBL	CHEMBL1171307
ZINC

Physicochemical Properties

Molecular Weight:	432.25
ALogP:	1.2413
MLogP:	3.55
XLogP:	4.376
# Rotatable Bonds:	14
Polar Surface Area:	115.06
# H-Bond Aceptor:	6
# H-Bond Donor:	4
# Rings:	3
# Heavy Atoms:	31

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