UCSF

ZINC00007339

Substance Information

In ZINC since Heavy atoms Benign functionality
October 4th, 2005 17 Yes

CAS Numbers: 1197333-54-2 , 57477-39-1

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 5.42 -40.52 3 3 1 40 231.319 1

Vendor Notes

Note Type Comments Provided By
Target 5-HT Receptor Selleck Chemicals
Purity 98% Fluorochem

Activity (Go SEA)

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