UCSF

ZINC34840137

Substance Information

In ZINC since Heavy atoms Benign functionality
September 29th, 2009 36 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) 6.20 15.93 -16 1 8 0 91 507.974 11
Lo Low (pH 4.5-6) 6.20 16.33 -38.4 2 8 1 92 508.982 11

Activity (Go SEA)

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