UCSF

ZINC14557640

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 12th, 2008 28 Yes

Popular Name: Isoapetalic acid Isoapetalic acid

Find On: PubMed — Wikipedia — Google

CAS Number: [34366-34-2]

Other Names:

MFCD20260987

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) 2.38 9.14 -52.59 1 6 -1 96 387.452 5 ↓

Activity (Go SEA)

Rings

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