UCSF

ZINC34218565

Substance Information

In ZINC since Heavy atoms Benign functionality
August 13th, 2009 18 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) 0.97 6.17 -51.18 2 5 1 54 245.306 1
Hi High (pH 8-9.5) 0.97 4.87 -12.46 1 5 0 50 244.298 1

Activity (Go SEA)

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