UCSF

ZINC02597091

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 29th, 2004 10 Yes

Popular Name: Isomannide Isomannide

Find On: PubMed — Wikipedia — Google

CAS Numbers: 28218-68-0 , 641-74-7 , [641-74-7]

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) -1.31 -5.71 -11.12 2 4 0 58 146.142 0 ↓

Vendor Notes

Note Type Comments Provided By
BP 150 / 12 TCI
MP 86 TCI

Activity (Go SEA)

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