UCSF

ZINC06473674

Substance Information

In ZINC since Heavy atoms Benign functionality
March 31st, 2006 23 No

Download: MOL2 SDF SMILES Flexibase

Annotations

None

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) 5.14 5.81 -40.47 1 4 -1 64 364.233 3
Mid Mid (pH 6-8) 5.14 6.59 -91.56 0 4 -2 67 363.225 3

Activity (Go SEA)

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