UCSF

ZINC17723737

Substance Information

In ZINC since Heavy atoms Benign functionality
September 24th, 2008 13 No

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) 0.62 2.89 -7.6 0 3 0 47 174.155 0
Ref Reference (pH 7) 2.40 -0.05 -10.9 2 3 0 52 174.155 0

Vendor Notes

Note Type Comments Provided By
melting_point 122 - 125 KeyOrganics

Activity (Go SEA)

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