UCSF

ZINC31995011

Substance Information

In ZINC since Heavy atoms Benign functionality
April 19th, 2009 20 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

    None

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) 2.31 7.02 -46.12 2 2 1 20 281.37 2
Hi High (pH 8-9.5) 2.31 7.59 -45.99 2 2 1 16 281.37 2

Activity (Go SEA)

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