UCSF

ZINC00087591

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 19 Yes

Popular Name: 1,5-DIPHENYL-1,5-PENTANEDIONE 1,5-DIPHENYL-1,5-PENTANEDIONE

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CAS Number: 6263-83-8

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) 3.65 2.25 -15.8 0 2 0 34 252.313 6 ↓

Vendor Notes

Note Type Comments Provided By
Mp [°C] 64 - 67 Acros Organics
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics

Activity (Go SEA)

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