UCSF

ZINC36163251

Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2009 18 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) -1.42 -1.39 -51.48 2 6 1 74 276.382 2
Hi High (pH 8-9.5) -1.42 -2.72 -15.52 1 6 0 70 275.374 2

Activity (Go SEA)

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