UCSF

ZINC06755011

Substance Information

In ZINC since Heavy atoms Benign functionality
April 22nd, 2006 17 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) 1.96 5.35 -24.69 2 3 1 43 253.391 2
Hi High (pH 8-9.5) 1.96 4.47 -8.75 1 3 0 41 252.383 2

Activity (Go SEA)

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