UCSF

ZINC35500387

Substance Information

In ZINC since Heavy atoms Benign functionality
October 8th, 2009 20 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) 2.47 7.16 -14.31 1 5 0 60 276.336 4
Hi High (pH 8-9.5) 2.66 4.99 -51.74 0 5 -1 66 275.328 4

Activity (Go SEA)

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