UCSF

ZINC04030871

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 2nd, 2005 21 No

Popular Name: 1-adamantyl(3-nitrobenzyl)amine 1-adamantyl(3-nitrobenzyl)amine

Find On: PubMed — Wikipedia — Google

CAS Number: 57304-72-0

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) 4.36 0.08 -52.66 2 4 1 62 287.383 4 ↓

Activity (Go SEA)

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