UCSF

ZINC04096681

Substance Information

In ZINC since Heavy atoms Benign functionality
November 7th, 2005 21 No

CAS Number: 362-06-1

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) 2.75 -1.75 -10.23 2 3 0 57 286.371 0

Vendor Notes

Note Type Comments Provided By
Patent Database Links US2007212427; US2008014642 ChEBI

Activity (Go SEA)

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