UCSF

ZINC28117264

Substance Information

In ZINC since Heavy atoms Benign functionality
February 24th, 2009 17 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) 2.32 2.23 -4.93 1 4 0 53 238.331 3
Ref Reference (pH 7) 2.69 5.3 -6.25 1 4 0 49 238.331 3

Activity (Go SEA)

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