UCSF

ZINC16215720

Substance Information

In ZINC since Heavy atoms Benign functionality
August 24th, 2008 21 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) 3.36 10.16 -11.97 1 3 0 28 340.279 6
Lo Low (pH 4.5-6) 3.36 10.44 -40.77 2 3 1 29 341.287 6

Activity (Go SEA)

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