UCSF

ZINC08701495

Substance Information

In ZINC since Heavy atoms Benign functionality
July 24th, 2007 15 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) 2.60 6 -10.34 1 2 0 29 217.293 2
Hi High (pH 8-9.5) 2.60 6.53 -52.1 1 2 -1 29 216.285 2

Activity (Go SEA)

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