UCSF

ZINC04240018

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 16th, 2005 20 Yes

Popular Name: 1-adamantyl(4-methoxybenzyl)amine 1-adamantyl(4-methoxybenzyl)amine

Find On: PubMed — Wikipedia — Google

CAS Number: 56916-85-9

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) 4.48 -0.42 -41.1 2 2 1 25 272.412 4 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID US4024274 IBM Patent Data

Activity (Go SEA)

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