UCSF

ZINC01680827

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 7th, 2004 10 Yes

Popular Name: 2,4,5-TRIMETHYLANILINE 2,4,5-TRIMETHYLANILINE

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CAS Numbers: 137-17-7 , 21436-97-5 , 94-48-4

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) 2.62 4.36 -3.04 2 1 0 26 135.21 0 ↓

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