UCSF

ZINC00897727

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 7th, 2005 22 Yes

Popular Name: Peonidin Peonidin

Find On: PubMed — Wikipedia — Google

CAS Number: 134-01-0

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) -0.44 -1.18 -38.01 4 6 1 101 301.274 2 ↓
Hi High (pH 8-9.5) -0.44 -0.4 -33.65 3 6 0 104 300.266 2 ↓
Hi High (pH 8-9.5) -0.44 -0.4 -39.66 3 6 0 104 300.266 2 ↓

Activity (Go SEA)

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