UCSF

ZINC43799901

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 19th, 2010 28 No

Popular Name: 4-amino-1-[(1R,3S,6S,8S,9R)-3,9-dihydroxy-3-oxo-2,4,7-trioxa-3$l^{5}-phosphabicyclo[4.3.0]nonan-8-yl 4-amino-1-[(1R,3S,6S,8S,9R)-3,9-…

Find On: PubMed — Wikipedia — Google

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) 1.35 2.52 -53.66 3 10 -1 149 416.391 8 ↓
Lo Low (pH 4.5-6) 1.35 3.7 -64.05 4 10 0 150 417.399 8 ↓

Activity (Go SEA)

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