NPASS Natural Product

Natural Product: NPC215300

Natural Product ID:	NPC215300
Common Name:	4,7-Dimethoxyphenanthren-2-Ol
IUPAC Name:	4,7-dimethoxyphenanthren-2-ol
Synonyms:
Molecular Formula:	C16H14O3
Standard InCHIKey:	BLEJCVUXRRNLMA-UHFFFAOYSA-N
Standard InCHI:	InChI=1S/C16H14O3/c1-18-13-5-6-14-10(8-13)3-4-11-7-12(17)9-15(19-2)16(11)14/h3-9,17H,1-2H3
Canonical SMILES:	COc1cc(O)cc2c1c1ccc(cc1cc2)OC
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
NPO1756	Cremastra appendiculata	Species	Orchidaceae	Eukaryota	tubers			PMID[16792409]
NPO1756	Cremastra appendiculata	Species	Orchidaceae	Eukaryota				TCM_Taiwan*

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 NPC215300 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	286
0.1-0.2	1431
0.2-0.3	2468
0.3-0.4	7962
0.4-0.5	5302
0.5-0.6	2692
0.6-0.7	5690
0.7-0.8	4339
0.8-0.85	517
0.85-0.9	134
0.9-0.95	59
0.95-1	9

Similarity Score	Similarity Level	Natural Product ID
0.9917	High Similarity	NPC53781
0.9836	High Similarity	NPC38017
0.9672	High Similarity	NPC170485
0.9669	High Similarity	NPC138248
0.9669	High Similarity	NPC228503
0.96	High Similarity	NPC282508
0.959	High Similarity	NPC105031
0.959	High Similarity	NPC278955
0.959	High Similarity	NPC105718
0.9453	High Similarity	NPC37410
0.9431	High Similarity	NPC113495
0.938	High Similarity	NPC472647
0.938	High Similarity	NPC206525
0.938	High Similarity	NPC191462
0.938	High Similarity	NPC472648
0.938	High Similarity	NPC133463
0.938	High Similarity	NPC472649
0.938	High Similarity	NPC170328
0.9365	High Similarity	NPC254000
0.9308	High Similarity	NPC266006
0.9308	High Similarity	NPC200935
0.9308	High Similarity	NPC71465
0.9308	High Similarity	NPC230919
0.9308	High Similarity	NPC472646
0.9308	High Similarity	NPC266453
0.9302	High Similarity	NPC258780
0.928	High Similarity	NPC473221
0.9237	High Similarity	NPC132804
0.9237	High Similarity	NPC105847
0.9237	High Similarity	NPC220344
0.9237	High Similarity	NPC243759
0.9237	High Similarity	NPC243996
0.9237	High Similarity	NPC218131
0.9237	High Similarity	NPC275061
0.92	High Similarity	NPC82299
0.918	High Similarity	NPC102639
0.9167	High Similarity	NPC273623
0.9167	High Similarity	NPC12668
0.9167	High Similarity	NPC308768
0.916	High Similarity	NPC56329
0.916	High Similarity	NPC151656
0.916	High Similarity	NPC242715
0.916	High Similarity	NPC22902
0.9147	High Similarity	NPC469610
0.9141	High Similarity	NPC8899
0.9141	High Similarity	NPC160623
0.9134	High Similarity	NPC471518
0.9134	High Similarity	NPC16577
0.9134	High Similarity	NPC471519
0.9106	High Similarity	NPC476633
0.9098	High Similarity	NPC103916
0.9091	High Similarity	NPC63010
0.9084	High Similarity	NPC30632
0.907	High Similarity	NPC469611
0.903	High Similarity	NPC183709
0.903	High Similarity	NPC175838
0.9016	High Similarity	NPC184302
0.9008	High Similarity	NPC10314
0.9008	High Similarity	NPC50521
0.9008	High Similarity	NPC221549
0.9008	High Similarity	NPC200557
0.9008	High Similarity	NPC244816
0.9008	High Similarity	NPC108198
0.9008	High Similarity	NPC241241
0.9008	High Similarity	NPC195466
0.9008	High Similarity	NPC294884
0.9008	High Similarity	NPC158142
0.9008	High Similarity	NPC69029
0.8992	High Similarity	NPC473309
0.8992	High Similarity	NPC471983
0.8992	High Similarity	NPC471517
0.8992	High Similarity	NPC149337
0.8976	High Similarity	NPC46978
0.8968	High Similarity	NPC293801
0.8939	High Similarity	NPC202846
0.8939	High Similarity	NPC143139
0.8939	High Similarity	NPC205442
0.8934	High Similarity	NPC131118
0.8934	High Similarity	NPC190514
0.8931	High Similarity	NPC160697
0.8931	High Similarity	NPC125649
0.8881	High Similarity	NPC295719
0.8881	High Similarity	NPC34431
0.8881	High Similarity	NPC73505
0.8881	High Similarity	NPC165026
0.8871	High Similarity	NPC100108
0.8871	High Similarity	NPC277798
0.8864	High Similarity	NPC111655
0.8864	High Similarity	NPC313081
0.8852	High Similarity	NPC474933
0.8852	High Similarity	NPC69261
0.8852	High Similarity	NPC33270
0.8846	High Similarity	NPC15543
0.8843	High Similarity	NPC167934
0.8837	High Similarity	NPC96719
0.8837	High Similarity	NPC222108
0.8806	High Similarity	NPC29868
0.8806	High Similarity	NPC212942
0.8806	High Similarity	NPC79622
0.8788	High Similarity	NPC473107
0.8779	High Similarity	NPC218884
0.8779	High Similarity	NPC228843
0.877	High Similarity	NPC150624
0.877	High Similarity	NPC229147
0.877	High Similarity	NPC141090
0.877	High Similarity	NPC203113
0.877	High Similarity	NPC85292
0.877	High Similarity	NPC54507
0.876	High Similarity	NPC249270
0.874	High Similarity	NPC270030
0.8731	High Similarity	NPC272157
0.8731	High Similarity	NPC90615
0.8731	High Similarity	NPC73535
0.8731	High Similarity	NPC25111
0.8731	High Similarity	NPC201145
0.8731	High Similarity	NPC6262
0.873	High Similarity	NPC18128
0.873	High Similarity	NPC77789
0.873	High Similarity	NPC57199
0.872	High Similarity	NPC129176
0.8702	High Similarity	NPC472590
0.8699	High Similarity	NPC25648
0.8689	High Similarity	NPC464
0.8689	High Similarity	NPC808
0.8689	High Similarity	NPC185541
0.8689	High Similarity	NPC53906
0.8682	High Similarity	NPC471986
0.8676	High Similarity	NPC265075
0.8676	High Similarity	NPC472089
0.8667	High Similarity	NPC184613
0.8657	High Similarity	NPC300846
0.8657	High Similarity	NPC114155
0.8657	High Similarity	NPC476639
0.8647	High Similarity	NPC103967
0.8647	High Similarity	NPC209199
0.8636	High Similarity	NPC14224
0.8636	High Similarity	NPC161958
0.8633	High Similarity	NPC274454
0.8633	High Similarity	NPC215678
0.8633	High Similarity	NPC126291
0.8626	High Similarity	NPC126836
0.8626	High Similarity	NPC315769
0.8615	High Similarity	NPC53986
0.8615	High Similarity	NPC23012
0.8615	High Similarity	NPC38664
0.8613	High Similarity	NPC472088
0.8613	High Similarity	NPC472087
0.8607	High Similarity	NPC107240
0.8607	High Similarity	NPC180508
0.8607	High Similarity	NPC22610
0.8607	High Similarity	NPC276737
0.8607	High Similarity	NPC228287
0.8605	High Similarity	NPC223953
0.8595	High Similarity	NPC280606
0.8594	High Similarity	NPC246648
0.8594	High Similarity	NPC134195
0.8594	High Similarity	NPC197351
0.8594	High Similarity	NPC106914
0.8594	High Similarity	NPC86502
0.8593	High Similarity	NPC35550
0.8583	High Similarity	NPC74137
0.8582	High Similarity	NPC11727
0.8582	High Similarity	NPC472370
0.8582	High Similarity	NPC283009
0.8582	High Similarity	NPC261873
0.8582	High Similarity	NPC15109
0.8582	High Similarity	NPC125579
0.8571	High Similarity	NPC32778
0.8571	High Similarity	NPC262297
0.8571	High Similarity	NPC174251
0.8571	High Similarity	NPC153182
0.8561	High Similarity	NPC191395
0.855	High Similarity	NPC93962
0.8548	High Similarity	NPC219070
0.8548	High Similarity	NPC127894
0.8548	High Similarity	NPC15860
0.8548	High Similarity	NPC470759
0.854	High Similarity	NPC71046
0.8538	High Similarity	NPC473134
0.8538	High Similarity	NPC266555
0.8537	High Similarity	NPC246760
0.8537	High Similarity	NPC84999
0.8529	High Similarity	NPC32630
0.8529	High Similarity	NPC114171
0.8529	High Similarity	NPC6300
0.8529	High Similarity	NPC230124
0.8527	High Similarity	NPC188022
0.8527	High Similarity	NPC76119
0.8527	High Similarity	NPC103420
0.8527	High Similarity	NPC4286
0.8527	High Similarity	NPC285040
0.8527	High Similarity	NPC17809
0.8527	High Similarity	NPC102540
0.8527	High Similarity	NPC105925
0.8525	High Similarity	NPC141003
0.8525	High Similarity	NPC117846
0.8525	High Similarity	NPC35344
0.8519	High Similarity	NPC141717
0.8516	High Similarity	NPC84086
0.8512	High Similarity	NPC296920

Similar Clinical/Approved Drugs

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

● The left chart: Distribution of similarity level between NPC215300 and all drugs/candidates.
● The right table: Most similar clinical/approved drugs (Tc>=0.56 or Top200).

range	Tanimoto Coefficient
0-0.1	308
0.1-0.2	1092
0.2-0.3	1173
0.3-0.4	2748
0.4-0.5	1919
0.5-0.6	1096
0.6-0.7	647
0.7-0.8	164
0.8-0.85	10
0.85-0.9	3
0.9-0.95	1
0.95-1	0

Similarity Score	Similarity Level	Drug ID	Developmental Stage
0.9134	High Similarity	NPD4625	Phase 3
0.8769	High Similarity	NPD4907	Clinical (unspecified phase)
0.8615	High Similarity	NPD4908	Phase 1
0.8504	High Similarity	NPD1610	Phase 2
0.8372	Intermediate Similarity	NPD4749	Approved
0.8333	Intermediate Similarity	NPD1548	Phase 1
0.8321	Intermediate Similarity	NPD6917	Clinical (unspecified phase)
0.8231	Intermediate Similarity	NPD3600	Clinical (unspecified phase)
0.8209	Intermediate Similarity	NPD6410	Clinical (unspecified phase)
0.8182	Intermediate Similarity	NPD2342	Discontinued
0.8102	Intermediate Similarity	NPD4097	Suspended
0.8062	Intermediate Similarity	NPD4626	Approved
0.806	Intermediate Similarity	NPD1529	Clinical (unspecified phase)
0.8	Intermediate Similarity	NPD3027	Phase 3
0.7985	Intermediate Similarity	NPD1530	Clinical (unspecified phase)
0.7956	Intermediate Similarity	NPD1612	Clinical (unspecified phase)
0.7956	Intermediate Similarity	NPD1613	Approved
0.7908	Intermediate Similarity	NPD6232	Discontinued
0.7903	Intermediate Similarity	NPD4750	Phase 3
0.7895	Intermediate Similarity	NPD1283	Approved
0.7887	Intermediate Similarity	NPD5698	Clinical (unspecified phase)
0.7852	Intermediate Similarity	NPD2861	Phase 2
0.7846	Intermediate Similarity	NPD1651	Approved
0.7801	Intermediate Similarity	NPD6099	Approved
0.7801	Intermediate Similarity	NPD6100	Approved
0.7761	Intermediate Similarity	NPD6696	Suspended
0.7756	Intermediate Similarity	NPD7473	Discontinued
0.7727	Intermediate Similarity	NPD6959	Discontinued
0.7717	Intermediate Similarity	NPD7635	Approved
0.7714	Intermediate Similarity	NPD1607	Approved
0.771	Intermediate Similarity	NPD5691	Approved
0.7698	Intermediate Similarity	NPD4060	Phase 1
0.7686	Intermediate Similarity	NPD1242	Phase 1
0.7669	Intermediate Similarity	NPD1281	Approved
0.7669	Intermediate Similarity	NPD422	Phase 1
0.7652	Intermediate Similarity	NPD2286	Discontinued
0.7647	Intermediate Similarity	NPD4624	Approved
0.7623	Intermediate Similarity	NPD846	Approved
0.7623	Intermediate Similarity	NPD940	Approved
0.7591	Intermediate Similarity	NPD3018	Phase 2
0.7586	Intermediate Similarity	NPD3750	Approved
0.7586	Intermediate Similarity	NPD7003	Approved
0.7571	Intermediate Similarity	NPD1240	Approved
0.7556	Intermediate Similarity	NPD1669	Approved
0.7551	Intermediate Similarity	NPD7041	Phase 2
0.7551	Intermediate Similarity	NPD7040	Clinical (unspecified phase)
0.7547	Intermediate Similarity	NPD5844	Phase 1
0.7538	Intermediate Similarity	NPD709	Approved
0.7537	Intermediate Similarity	NPD1611	Approved
0.7518	Intermediate Similarity	NPD6584	Phase 3
0.75	Intermediate Similarity	NPD7447	Phase 1
0.75	Intermediate Similarity	NPD37	Approved
0.75	Intermediate Similarity	NPD4378	Clinical (unspecified phase)
0.7483	Intermediate Similarity	NPD1509	Clinical (unspecified phase)
0.7483	Intermediate Similarity	NPD1510	Phase 2
0.748	Intermediate Similarity	NPD5451	Approved
0.7468	Intermediate Similarity	NPD7768	Phase 2
0.7466	Intermediate Similarity	NPD6398	Clinical (unspecified phase)
0.7452	Intermediate Similarity	NPD7229	Phase 3
0.7451	Intermediate Similarity	NPD7819	Suspended
0.7448	Intermediate Similarity	NPD970	Clinical (unspecified phase)
0.7447	Intermediate Similarity	NPD3619	Clinical (unspecified phase)
0.7447	Intermediate Similarity	NPD3620	Phase 2
0.7432	Intermediate Similarity	NPD7390	Discontinued
0.7432	Intermediate Similarity	NPD7212	Phase 2
0.7432	Intermediate Similarity	NPD7213	Phase 3
0.7429	Intermediate Similarity	NPD6812	Clinical (unspecified phase)
0.7429	Intermediate Similarity	NPD6859	Clinical (unspecified phase)
0.7426	Intermediate Similarity	NPD2982	Phase 2
0.7426	Intermediate Similarity	NPD2983	Phase 2
0.7426	Intermediate Similarity	NPD5327	Phase 3
0.7405	Intermediate Similarity	NPD6671	Approved
0.7403	Intermediate Similarity	NPD8443	Clinical (unspecified phase)
0.7394	Intermediate Similarity	NPD5735	Approved
0.7385	Intermediate Similarity	NPD1398	Phase 1
0.7385	Intermediate Similarity	NPD5283	Phase 1
0.7383	Intermediate Similarity	NPD2534	Approved
0.7383	Intermediate Similarity	NPD2533	Approved
0.7383	Intermediate Similarity	NPD7410	Clinical (unspecified phase)
0.7383	Intermediate Similarity	NPD7004	Clinical (unspecified phase)
0.7383	Intermediate Similarity	NPD2532	Approved
0.7372	Intermediate Similarity	NPD6234	Discontinued
0.7368	Intermediate Similarity	NPD3091	Approved
0.7364	Intermediate Similarity	NPD228	Approved
0.7355	Intermediate Similarity	NPD4967	Phase 2
0.7355	Intermediate Similarity	NPD4965	Approved
0.7355	Intermediate Similarity	NPD4966	Approved
0.7353	Intermediate Similarity	NPD2981	Phase 2
0.7348	Intermediate Similarity	NPD7340	Approved
0.7347	Intermediate Similarity	NPD3892	Phase 2
0.7338	Intermediate Similarity	NPD2393	Clinical (unspecified phase)
0.7329	Intermediate Similarity	NPD7037	Approved
0.7324	Intermediate Similarity	NPD4140	Approved
0.7324	Intermediate Similarity	NPD2238	Phase 2
0.7317	Intermediate Similarity	NPD3020	Approved
0.731	Intermediate Similarity	NPD5408	Approved
0.731	Intermediate Similarity	NPD2935	Discontinued
0.731	Intermediate Similarity	NPD5404	Approved
0.731	Intermediate Similarity	NPD5405	Approved
0.731	Intermediate Similarity	NPD5406	Approved
0.7303	Intermediate Similarity	NPD5808	Clinical (unspecified phase)
0.7299	Intermediate Similarity	NPD6582	Phase 2
0.7299	Intermediate Similarity	NPD6583	Phase 3
0.7295	Intermediate Similarity	NPD288	Approved
0.7279	Intermediate Similarity	NPD6674	Discontinued
0.7279	Intermediate Similarity	NPD3092	Approved
0.7273	Intermediate Similarity	NPD5124	Phase 1
0.7273	Intermediate Similarity	NPD5123	Clinical (unspecified phase)
0.726	Intermediate Similarity	NPD1550	Clinical (unspecified phase)
0.726	Intermediate Similarity	NPD1552	Clinical (unspecified phase)
0.7256	Intermediate Similarity	NPD8453	Clinical (unspecified phase)
0.7246	Intermediate Similarity	NPD8651	Approved
0.7241	Intermediate Similarity	NPD4108	Discontinued
0.7241	Intermediate Similarity	NPD3748	Approved
0.723	Intermediate Similarity	NPD7466	Approved
0.7226	Intermediate Similarity	NPD2230	Approved
0.7226	Intermediate Similarity	NPD2233	Approved
0.7226	Intermediate Similarity	NPD2232	Approved
0.7222	Intermediate Similarity	NPD4579	Clinical (unspecified phase)
0.7222	Intermediate Similarity	NPD6353	Approved
0.7215	Intermediate Similarity	NPD6746	Phase 2
0.7213	Intermediate Similarity	NPD2859	Approved
0.7213	Intermediate Similarity	NPD844	Approved
0.7213	Intermediate Similarity	NPD2860	Approved
0.7211	Intermediate Similarity	NPD1549	Phase 2
0.7208	Intermediate Similarity	NPD7411	Suspended
0.7203	Intermediate Similarity	NPD2979	Phase 3
0.7197	Intermediate Similarity	NPD3749	Approved
0.7194	Intermediate Similarity	NPD3094	Phase 2
0.719	Intermediate Similarity	NPD3226	Approved
0.717	Intermediate Similarity	NPD7199	Phase 2
0.7162	Intermediate Similarity	NPD7421	Clinical (unspecified phase)
0.7161	Intermediate Similarity	NPD1934	Approved
0.7153	Intermediate Similarity	NPD1201	Approved
0.7143	Intermediate Similarity	NPD4380	Phase 2
0.7143	Intermediate Similarity	NPD7852	Clinical (unspecified phase)
0.7132	Intermediate Similarity	NPD4059	Approved
0.7132	Intermediate Similarity	NPD3019	Approved
0.7131	Intermediate Similarity	NPD2934	Approved
0.7131	Intermediate Similarity	NPD2933	Approved
0.7109	Intermediate Similarity	NPD968	Approved
0.7105	Intermediate Similarity	NPD4319	Phase 2
0.7105	Intermediate Similarity	NPD5261	Clinical (unspecified phase)
0.7101	Intermediate Similarity	NPD1608	Approved
0.7091	Intermediate Similarity	NPD6559	Discontinued
0.7086	Intermediate Similarity	NPD1511	Approved
0.7081	Intermediate Similarity	NPD7184	Clinical (unspecified phase)
0.7078	Intermediate Similarity	NPD4005	Discontinued
0.7077	Intermediate Similarity	NPD3021	Approved
0.7077	Intermediate Similarity	NPD3022	Approved
0.7075	Intermediate Similarity	NPD1551	Phase 2
0.7075	Intermediate Similarity	NPD2438	Suspended
0.7075	Intermediate Similarity	NPD2796	Approved
0.7071	Intermediate Similarity	NPD4339	Clinical (unspecified phase)
0.7071	Intermediate Similarity	NPD2797	Approved
0.7068	Intermediate Similarity	NPD497	Approved
0.7063	Intermediate Similarity	NPD3764	Approved
0.7059	Intermediate Similarity	NPD4093	Discontinued
0.7055	Intermediate Similarity	NPD7228	Approved
0.7045	Intermediate Similarity	NPD5535	Approved
0.7027	Intermediate Similarity	NPD5763	Approved
0.7027	Intermediate Similarity	NPD5762	Approved
0.7027	Intermediate Similarity	NPD2029	Clinical (unspecified phase)
0.7027	Intermediate Similarity	NPD2346	Discontinued
0.7027	Intermediate Similarity	NPD3540	Phase 1
0.7025	Intermediate Similarity	NPD4581	Clinical (unspecified phase)
0.7025	Intermediate Similarity	NPD4868	Clinical (unspecified phase)
0.702	Intermediate Similarity	NPD6815	Approved
0.7007	Intermediate Similarity	NPD2667	Approved
0.7007	Intermediate Similarity	NPD3095	Discontinued
0.7007	Intermediate Similarity	NPD2668	Approved
0.7007	Intermediate Similarity	NPD5846	Approved
0.7007	Intermediate Similarity	NPD6516	Phase 2
0.7007	Intermediate Similarity	NPD1778	Approved
0.7007	Intermediate Similarity	NPD2932	Approved
0.7006	Intermediate Similarity	NPD5929	Approved
0.7006	Intermediate Similarity	NPD2801	Approved
0.7	Intermediate Similarity	NPD2684	Approved
0.6993	Remote Similarity	NPD1512	Approved
0.6993	Remote Similarity	NPD7095	Approved
0.6993	Remote Similarity	NPD1940	Clinical (unspecified phase)
0.6992	Remote Similarity	NPD496	Approved
0.6992	Remote Similarity	NPD4869	Clinical (unspecified phase)
0.6992	Remote Similarity	NPD495	Approved
0.6992	Remote Similarity	NPD498	Approved
0.6987	Remote Similarity	NPD7615	Clinical (unspecified phase)
0.6986	Remote Similarity	NPD2157	Approved
0.6984	Remote Similarity	NPD289	Clinical (unspecified phase)
0.6981	Remote Similarity	NPD4055	Discovery
0.6981	Remote Similarity	NPD7075	Discontinued
0.6972	Remote Similarity	NPD5736	Approved
0.6966	Remote Similarity	NPD5837	Clinical (unspecified phase)
0.6959	Remote Similarity	NPD2531	Phase 2
0.6959	Remote Similarity	NPD3539	Phase 1
0.6959	Remote Similarity	NPD4477	Approved
0.6959	Remote Similarity	NPD4476	Approved
0.695	Remote Similarity	NPD1470	Approved
0.6944	Remote Similarity	NPD7294	Phase 1
0.6944	Remote Similarity	NPD6798	Discontinued
0.6939	Remote Similarity	NPD4536	Approved

Structure

External Identifiers

PubChem CID	11557896
ChEMBL	CHEMBL497447
ZINC

Physicochemical Properties

Molecular Weight:	254.09
ALogP:	-0.5639
MLogP:	2.89
XLogP:	3.431
# Rotatable Bonds:	5
Polar Surface Area:	38.69
# H-Bond Aceptor:	0
# H-Bond Donor:	1
# Rings:	3
# Heavy Atoms:	19

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