Substance Information
| In ZINC since |
Heavy atoms |
Benign functionality |
| October 24th, 2009 |
40 |
No
|
Other Names:
2-[(1R,2R,3S,4R,5R,6S)-3-(diaminomethylideneamino)-4-[(2R,3R,4R,5S)-3-[(2S,3S,4S,5R,6S)-4,5-dihydroxy-6-(hydroxymethyl)-3-(methylamino)oxan-2-yl]oxy-4-formyl-4-hydroxy-5-methyloxolan-2-yl]oxy-2,5,6-tr; ihydroxycyclohexyl]guanidine
Streptomycin
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)
|
-5.35 |
-10.8 |
-165.29 |
19 |
19 |
3 |
344 |
584.604 |
9 |
↓
|
|
Mid
Mid (pH 6-8)
|
-5.35 |
-11.93 |
-94.55 |
18 |
19 |
2 |
340 |
583.596 |
9 |
↓
|
Vendor Notes
| Note Type |
Comments |
Provided By |
| Molecular_Solubility |
1.322 |
Bitter DB |
No pre-computed analogs available. Try a structural similarity search.
