Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	-1.00	-4.58	-8.56	4	3	0	69	60.056	0	↓ MOL2 SDF SMILES Flexibase
Ref Reference (pH 7)	-1.24	-6.13	-32.9	5	3	1	72	61.064	0	↓ MOL2 SDF SMILES Flexibase

Vendor Notes

Note Type	Comments	Provided By
Melting_Point	130-135?	Alfa-Aesar
Melting_Point	130-135°	Alfa-Aesar
Mp [°C]	131 - 135	Acros Organics
Melting_Point	132-135?	Alfa-Aesar
Melting_Point	132-135°	Alfa-Aesar
ALOGPS_SOLUBILITY	4.12e+02 g/l	DrugBank-experimental
UniProt Database Links	6HN3M_PSEFL; AAH_ARATH; AAH_ORYSJ; ACYP_ECOLI; AL4A1_BOVIN; AL4A1_DANRE; AL4A1_DICDI; AL4A1_HUMAN; AL4A1_MOUSE; AL4A1_RAT; ALLA1_RHIME; ALLA2_RHIME; ALLA_AGRT5; ALLA_AZOVD; ALLA_BRUA1; ALLA_BRUA2; ALLA_BRUAB; ALLA_BRUC2; ALLA_BRUMB; ALLA_BRUME; ALLA_BRUO2	ChEBI
Mp [°C]	75 - 85	Acros Organics
Notes	Chaotropic agent used in denaturing polyacrylamide gel electrophoresisDNases/RNases/Proteases not detected	Apollo Scientific Bioactives
Therapy	diuretic	SMDC MicroSource
Patent Database Links	EP0784051; EP0808836; EP0816309; EP0816351; EP0823427; EP0869122; EP0885937; EP0889040; EP0896961; EP0923986; EP0927740; EP0927744; EP0936216; EP0942051; EP0949301; EP0953569; EP0970951; EP0976738; EP0976796; EP1013276; EP1026158; EP1035117; EP1036794; EP	ChEBI
H phrase	H314: Causes severe skin burns and eye damage	Acros Organics
H phrase	H314: Causes severe skin burns and eye damage; H272: May intensify fire; oxidizer	Acros Organics
H phrase	H315: Causes skin irritation	Acros Organics
Hazard	O: Oxidizing	Acros Organics
Hazard	O: Oxidizing; C: Corrosive	Acros Organics
P phrase	P301 + P330 + P331: IF SWALLOWED: rinse mouth. Do NOT induce vomiting	Acros Organics
P phrase	P301 + P330 + P331: IF SWALLOWED: rinse mouth. Do NOT induce vomiting; P280: Wear eye protection/face protection; P305 + P351 + P338: IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue r	Acros Organics
P phrase	P302+ P352: IF ON SKIN: Wash with plenty of soap and water	Acros Organics
R phrase	R34: Causes burns.	Acros Organics
R phrase	R34: Causes burns.; R8: Contact with combustible material may cause fire.	Acros Organics
R phrase	R38: Irritating to skin.	Acros Organics
Reactome Database Links	REACT_20655; REACT_21325; REACT_23825; REACT_23949; REACT_394	ChEBI
S phrase	S17: Keep away from combustible material.	Acros Organics
S phrase	S17: Keep away from combustible material.; S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.; S36/37/39: Wear suitable protective clothing, gloves and eye/face protection.; S45: In case of accident or if yo	Acros Organics
S phrase	S37: Wear suitable gloves.	Acros Organics
Hazard	XI: Irritant	Acros Organics

Activity (Go SEA)

Direct Reactome Annotations (via ChEBI)

Description	Species
Agmatine biosynthesis	Plasmodium falciparum Bos taurus Drosophila melanogaster Taeniopygia guttata Xenopus tropicalis Mus musculus Homo sapiens Caenorhabditis elegans Saccharomyces cerevisiae Schizosaccharomyces pombe Sus scrofa Canis familiaris Oryza sativa Arabidopsis thaliana Gallus gallus Rattus norvegicus Danio rerio
Arginine metabolism	Gallus gallus
Passive transport by Aquaporins	Danio rerio Saccharomyces cerevisiae Rattus norvegicus Homo sapiens Canis familiaris Mus musculus Gallus gallus Schizosaccharomyces pombe Sus scrofa Xenopus tropicalis Plasmodium falciparum Taeniopygia guttata Caenorhabditis elegans Bos taurus
Transport of glucose and other sugars, bile salts and organic acids, metal ions	Danio rerio Gallus gallus Homo sapiens Mus musculus Sus scrofa Xenopus tropicalis Rattus norvegicus Taeniopygia guttata Canis familiaris Bos taurus
Urea cycle	Sus scrofa Taeniopygia guttata Rattus norvegicus Mus musculus Homo sapiens Danio rerio Saccharomyces cerevisiae Drosophila melanogaster Arabidopsis thaliana Canis familiaris Plasmodium falciparum Xenopus tropicalis Gallus gallus Schizosaccharomyces pombe Bos taurus

Analogs ( Draw Identity 99% 90% 80% 70% )

No pre-computed analogs available. Try a structural similarity search.

Synonyms (51)
Vendors (9)
Annotations (28)
Representations (2)
Notes (27)
Targets (0)
Clustered (0)
Reactome (0)
Rings (0)
Analogs (0)