UCSF

ZINC16524200

Substance Information

In ZINC since Heavy atoms Benign functionality
August 30th, 2008 32 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) 5.60 9.35 -10.37 0 6 0 56 447.922 5
Lo Low (pH 4.5-6) 5.60 11.66 -43.93 1 6 1 57 448.93 5

Activity (Go SEA)

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