C38h37n3o8 nondum assignata

Basic Information:

Mitte inscriptio nobis

Product Detail

Product Tags

Physica proprietatibus

Key physica proprietatibus	Valor	Conditio
Pondus	663,72	-
Density (praedicta)	1.304 ± 0.06 G / CM3	Temp: XX ° C; Press: DCCLX Torr
Pka (praedicta)	8,27 ± 0.10	Most Acidic Temp: XXV ° C

Alia nomina et identifiers

Canonical SMILES O=C1NC(=O)N(C=C1C(=O)NCC=2C=CC=CC2)C3OC(COC(C=4C=CC=CC4)(C5=CC=C(OC)C=C5)C6=CC=C(OC)C=C6)C(O)C3
Isomeric smiles
C(OC[C@H]1O[C@H](C[C@@H]1O)N2C=C(C(NCC3=CC=CC=C3)=O)C(=O)NC2=O)(C4=CC=C(OC)C=C4)(C5=CC=C(OC)C=C5)C6=CC=CC=C 6
INCHI
Inchi = 1s / C38H37N3O8 / C1-46-29-17-13-27 (14-18-29) XXXVIII (26-11-7-4-8-12-26,28-15-19-30 (47-2) 20-16-28) 49-24-33-32 (XLII) 21-34 (49-33) IV 1-23-31 (XXXVI (XLIV) 40-37 (XLI) XLV) XXXV (XLIII) 39-22-25-9-5-3-6-10-25 / H3-20,23,32-34,42h, 21-22,24H2,1-2H3 (H, 39,43) (H 40,44,45) / T32
, XXXIII +, XXXIV + / M0 / S1
Key Inchi
NZBGRVLZISISISISISISISISISISISISPURB, LBFZIJHGSA, N

Praedixit possessiones

Proprietatibus praesto

Biological

Proprietatibus praesto

Proiectus

Densitas

Lipinski

Structuram related

Biological

Res	Valor	Conditio	Fons
Bioconcentration factor	(V) CCL	PH I; Temp: XXV ° C	(I) ACD
Bioconcentration factor	(V) CCL	PH II; Temp: XXV ° C	(I) ACD
Bioconcentration factor	(V) CCLX	PH III; Temp: XXV ° C	(I) ACD
Bioconcentration factor	(V) CCLX	PH IV; Temp: XXV ° C	(I) ACD
Bioconcentration factor	(V) CCL	PH V; Temp: XXV ° C	(I) ACD
Bioconcentration factor	(V) CC	Ph VI; Temp: XXV ° C	(I) ACD
Bioconcentration factor	(IV) DCCXX	PH VII; Temp: XXV ° C	(I) ACD
Bioconcentration factor	MMCDLX	PH VIII; Temp: XXV ° C	(I) ACD
Bioconcentration factor	CDLXVI	PH IX; Temp: XXV ° C	(I) ACD
Bioconcentration factor	96.9	PH X; Temp: XXV ° C	(I) ACD

Proiectus

Res	Valor	Conditio	Fons
Koc	(XVI)	PH I; Temp: XXV ° C	(I) ACD
Koc	(XVI)	PH II; Temp: XXV ° C	(I) ACD
Koc	(XVI)	PH III; Temp: XXV ° C	(I) ACD
Koc	(XVI)	PH IV; Temp: XXV ° C	(I) ACD
Koc	(XVI)	PH V; Temp: XXV ° C	(I) ACD
Koc	(XV) DCCC	Ph VI; Temp: XXV ° C	(I) ACD
Koc	(XIV) CD	PH VII; Temp: XXV ° C	(I) ACD
Koc	(VII) DX	PH VIII; Temp: XXV ° C	(I) ACD
Koc	MCDXX	PH IX; Temp: XXV ° C	(I) ACD
Koc	CCXCVI	PH X; Temp: XXV ° C	(I) ACD
logd	5.20	PH I; Temp: XXV ° C	(I) ACD
logd	5.20	PH II; Temp: XXV ° C	(I) ACD
logd	5.20	PH III; Temp: XXV ° C	(I) ACD

Res	Valor	Conditio	Fons
logd	5.20	PH IV; Temp: XXV ° C	(I) ACD
logd	5.20	PH V; Temp: XXV ° C	(I) ACD
logd	5,19	Ph VI; Temp: XXV ° C	(I) ACD
logd	5.15	PH VII; Temp: XXV ° C	(I) ACD
logd	4.87	PH VIII; Temp: XXV ° C	(I) ACD
logd	4.15	PH IX; Temp: XXV ° C	(I) ACD
logd	3.46	PH X; Temp: XXV ° C	(I) ACD
logp	5,198 ± 0.644	Temp: XXV ° C	(I) ACD
Missam intrinsecam solubility	9.3 x 10-6 g / l	Temp: XXV ° C	(I) ACD
Missam solubility	9.3 x 10-6 g / l	PH I; Temp: XXV ° C	(I) ACD
Missam solubility	9.3 x 10-6 g / l	PH II; Temp: XXV ° C	(I) ACD
Missam solubility	9.3 x 10-6 g / l	PH III; Temp: XXV ° C	(I) ACD
Missam solubility	9.3 x 10-6 g / l	PH IV; Temp: XXV ° C	(I) ACD
Missam solubility	9.3 x 10-6 g / l	PH V; Temp: XXV ° C	(I) ACD
Missam solubility	9.3 x 10-6 g / l	Ph VI; Temp: XXV ° C	(I) ACD
Missam solubility	X 10-5 G / l	PH VII; Temp: XXV ° C	(I) ACD
Missam solubility	2.0 x 10-5 g / l	PH VIII; Temp: XXV ° C	(I) ACD
Missam solubility	X 10-4 G / l	PH IX; Temp: XXV ° C	(I) ACD
Missam solubility	5.1 x 10-4 g / l	PH X; Temp: XXV ° C	(I) ACD
Missam solubility	X 10-5 G / l	Unbuffered aqua PH 7.00; Temp: XXV ° C	(I) ACD
Molaris intrinsecam solubility	X 10-8 Mol / l	Temp: XXV ° C	(I) ACD
Molaris solubility	X 10-8 Mol / l	PH I; Temp: XXV ° C	(I) ACD
Molaris solubility	X 10-8 Mol / l	PH II; Temp: XXV ° C	(I) ACD
Molaris solubility	X 10-8 Mol / l	PH III; Temp: XXV ° C	(I) ACD
Molaris solubility	X 10-8 Mol / l	PH IV; Temp: XXV ° C	(I) ACD
Molaris solubility	X 10-8 Mol / l	PH V; Temp: XXV ° C	(I) ACD
Molaris solubility	X 10-8 Mol / l	Ph VI; Temp: XXV ° C	(I) ACD
Molaris solubility	1.6 x 10-8 Mol / l	PH VII; Temp: XXV ° C	(I) ACD
Molaris solubility	10-8 Mol X 3.0 / l	PH VIII; Temp: XXV ° C	(I) ACD
Molaris solubility	1.6 x 10-7 Mol / l	PH IX; Temp: XXV ° C	(I) ACD
Molaris solubility	7.7 x 10-7 Mol / l	PH X; Temp: XXV ° C	(I) ACD
Molaris solubility	1.6 x 10-8 Mol / l	Unbuffered aqua PH 7.00; Temp: XXV ° C	(I) ACD

Res	Valor	Conditio	Fons
Pondus	663,72
PKA	8,27 ± 0.10	Most Acidic Temp: XXV ° C	(I) ACD
PKA	-1.66 ± 0.20	Maxime basic temp: XXV °	(I) ACD

Densitas

Res	Valor	Conditio	Fons
Densitas	1.304 ± 0.06 G / CM3	Temp: XX ° C; Press: DCCLX Torr	(I) ACD
Molaris volumine	508.6 ± 3.0 cm3 / mol	Temp: XX ° C; Press: DCCLX Torr	(I) ACD

Lipinski

Res	Valor	Conditio	Fons
Sponte Rotatable vincula	13		(I) ACD
H acceptors	11		(I) ACD
H donos	3		(I) ACD
H donator / Acceptor Sum	14		(I) ACD
logp	5,198 ± 0.644	Temp: XXV ° C	(I) ACD
Pondus	663,72