UCSF

ZINC04031808

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 3rd, 2005 22 Yes

Popular Name: 4,4',4''-Methanetriyltrianiline 4,4',4''-Methanetriyltrianiline

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CAS Numbers: 548-61-8 , [548-61-8]

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) 2.33 -3.62 -5.19 6 3 0 78 289.382 3 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem

Activity (Go SEA)

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