UCSF

ZINC00153962

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 15th, 2005 16 Yes

Popular Name: 3-(Aminomethyl)-1-N-Boc-aniline 3-(Aminomethyl)-1-N-Boc-aniline

Find On: PubMed — Wikipedia — Google

CAS Numbers: 1038549-44-8 , 205318-52-1 , [205318-52-1]

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) 1.99 2.78 -51.54 4 4 1 66 223.296 4 ↓

Vendor Notes

Note Type Comments Provided By
MP 130-134° Matrix Scientific
MP 135-138° Matrix Scientific
Purity 95% Fluorochem
Warnings Irritant Matrix Scientific

Activity (Go SEA)

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