Substance Information
| In ZINC since |
Heavy atoms |
Benign functionality |
| January 10th, 2011 |
33 |
Yes
|
Other Names:
(2R)-2-[(4-{[(2-amino-5-methyl-4-oxo-3,6,7,8-tetrahydropteridin-6-yl)methyl]amino}phenyl)formamido]pentanedioic acid
(6S)-5-methyltetrahydrofolate; [(6S)-5-methyl-5,6,7,8-tetrahydropteroyl]glutamate; 5-Methyl tetrahydrofolate; 5-methyl-5,6,7,8-tetrahydrofolate; 5-methyl-tetrahydrofolate; 5-Methyltetrahydrofolate; 5-Methyltetrahydropteroylglutamate; Methyl folate; methyl
5-Methyl tetrahydrofolate; 5-Methyl-5,6,7,8-tetrahydrofolate; 5-Methyl-tetrahydrofolate; 5-Methyltetrahydrofolate; 5-Methyltetrahydropteroylglutamate; Methyl folate; Methyl-tetrahydrofolate; N( 5)-Methyltetrahydrofolate; N-(4-(((2-Amino-1,4,5,6,7,8-hexahy
5-Methyl tetrahydrofolate;5-Methyl-5,6,7,8-tetrahydrofolate;5-Methyl-tetrahydrofolate;5-Methyltetrahydrofolate;5-Methyltetrahydropteroylglutamate;Methyl folate;Methyl-tetrahydrofolate;N( 5)-Methyltetrahydrofolate;N-(4-(((2-Amino-1,4,5,6,7,8-hexahydro-5-me
calcium 5-methyltetrahydrofolate
L-5-Methyltetrahydrofolate calcium
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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)
|
-2.42 |
4.8 |
-137.63 |
6 |
13 |
-2 |
208 |
457.447 |
9 |
↓
|
|
Mid
Mid (pH 6-8)
|
-2.42 |
4.84 |
-142.05 |
7 |
13 |
-1 |
210 |
458.455 |
9 |
↓
|
|
Lo
Low (pH 4.5-6)
|
-2.42 |
2.92 |
-94.98 |
8 |
13 |
0 |
207 |
459.463 |
9 |
↓
|
|
Lo
Low (pH 4.5-6)
|
-2.42 |
3.61 |
-84.62 |
8 |
13 |
0 |
207 |
459.463 |
9 |
↓
|
No pre-computed analogs available. Try a structural similarity search.
