UCSF

ZINC60183168

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
March 16th, 2011 42 No

Popular Name: Aminosidin sulfate; Aminosidine sulfate; Aminosidine sulphate; C23H45N5O14.H2O4S; D-Streptamine, O-2-amino-2-deoxy-alpha-D-glucopyranosyl-(1-4)-O-(O-2,6-diamino-2,6-dideoxy-beta-L-idopyranosyl-(1-3)-beta-D-ribofuranosyl-(1-5))-2-deoxy-, sulfate (salt); EI Aminosidin sulfate; Aminosidine …

Find On: PubMed — Wikipedia — Google

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

    None

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) -6.04 -23.95 -303.85 22 19 4 354 619.666 9 ↓
Hi High (pH 8-9.5) -6.04 -25.12 -59.11 19 19 1 349 616.642 9 ↓
Hi High (pH 8-9.5) -6.04 -24.76 -111.63 20 19 2 351 617.65 9 ↓
Mid Mid (pH 6-8) -6.04 -23.46 -392.14 23 19 5 355 620.674 9 ↓
Mid Mid (pH 6-8) -6.04 -23.82 -267.37 22 19 4 354 619.666 9 ↓
Mid Mid (pH 6-8) -6.04 -24.31 -190.05 21 19 3 352 618.658 9 ↓

Activity (Go SEA)

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

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