UCSF

ZINC27527409

Substance Information

In ZINC since Heavy atoms Benign functionality
February 16th, 2009 26 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) 1.08 5.01 -33.32 2 10 0 124 356.342 4
Hi High (pH 8-9.5) 1.08 5.81 -73.33 1 10 -1 126 355.334 4

Activity (Go SEA)

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