UCSF

ZINC35843627

Substance Information

In ZINC since Heavy atoms Benign functionality
October 13th, 2009 30 No

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) 4.76 13.32 -18.88 0 6 0 69 447.988 8
Mid Mid (pH 6-8) 4.76 14.93 -71.85 1 6 1 71 448.996 8

Activity (Go SEA)

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