UCSF

ZINC00909148

Substance Information

In ZINC since Heavy atoms Benign functionality
November 1st, 2005 31 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) 2.73 2.81 -48.32 2 7 1 80 445.923 8
Mid Mid (pH 6-8) 2.15 3.22 -58.96 1 7 1 77 445.923 8

Activity (Go SEA)

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