UCSF

ZINC12358699

Substance Information

In ZINC since Heavy atoms Benign functionality
May 9th, 2008 13 No

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 2.73 -0.72 -47 0 3 -1 52 172.163 1

Vendor Notes

Note Type Comments Provided By
Melting_Point 154-158? dec. Alfa-Aesar
Melting_Point 154-158° dec. Alfa-Aesar

Activity (Go SEA)

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