UCSF

ZINC00542263

Substance Information

In ZINC since Heavy atoms Benign functionality
July 24th, 2004 23 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) 4.37 -0.96 -14.18 1 3 0 41 340.473 5
Hi High (pH 8-9.5) 4.37 -1.91 -50.06 1 3 -1 41 339.465 5

Activity (Go SEA)

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