Substance Information
| In ZINC since |
Heavy atoms |
Benign functionality |
| October 5th, 2005 |
36 |
No
|
Other Names:
(R-(R*,R*))-N,N'-(Dithiobis(ethyleneimino(3-oxopropane-3,1-diyl)))bis(2,4-dihydroxy-3,3-dimethylbutyramide); Bis(N-pantothenylamidoethyl) disulfide; Bis(pantothenamidoethyl) disulfide; Butanamide, N,N'-(dithiobis(2,1-ethanediylimino(3-oxo-3,1-propanediyl)
(R-(R*,R*))-N,N'-(Dithiobis(ethyleneimino(3-oxopropane-3,1-diyl)))bis(2,4-dihydroxy-3,3-dimethylbutyramide); Bis(pantothenamidoethyl) disulfide; D-Bis(N-pantothenyl-beta-aminoethyl) disulfide; D-pantethine; N-[2-[2-[2-[3-[(2,4-dihydroxy-3,3-dimethyl-butan
16816-67-4; C12661; Pantethine
16816-67-4; D01234; Pantethine (JP16); Pantosin (TN)
D-Pantethine
Pantethine (JAN)
Pantethine;Pantosin (TN)
Download:
MOL2
SDF
SMILES
Flexibase
Physical Representations
|
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
(Ų)
|
MWT
Molecular weight
(g/mol)
|
RB
Rotatable bonds
|
DL |
|
Ref
Reference (pH 7)
|
-1.93 |
-15.57 |
-38.08 |
8 |
12 |
0 |
197 |
554.732 |
19 |
↓
|
Vendor Notes
| Note Type |
Comments |
Provided By |
| Therapy |
antilipemic |
SMDC Pharmakon |
| PUBCHEM_PATENT_ID |
EP0131995A1; EP0200208A2; EP0200208B1; EP0223257A2; EP0223257B1; EP0231925A2; EP0281394A2; EP0313302A2; EP0313302B1; EP0313303A2; EP0313303B1; EP0313304A2; EP0313304B1; EP0313305A2; EP0313347A2; EP0316438B1; EP0323855A2; EP0323855B1; EP0330369A1; EP042501 |
IBM Patent Data |
No pre-computed analogs available. Try a structural similarity search.
