UCSF

ZINC05390773

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
January 31st, 2006 17 No

Popular Name: 5-nitro-2-piperidinobenzenecarbaldehyde 5-nitro-2-piperidinobenzenecarba…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 30742-60-0 , [30742-60-0]

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) 2.63 1.56 -7.55 0 5 0 66 234.255 3 ↓

Vendor Notes

Note Type Comments Provided By
MP 122-123° Matrix Scientific
Purity >95% Matrix Scientific
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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