UCSF

ZINC34668538

Substance Information

In ZINC since Heavy atoms Benign functionality
September 18th, 2009 29 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 2.40 7.77 -43.8 2 7 1 68 400.499 7
Mid Mid (pH 6-8) 2.40 5.55 -9.66 1 7 0 67 399.491 7

Activity (Go SEA)

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