UCSF

ZINC46512353

Substance Information

In ZINC since Heavy atoms Benign functionality
August 13th, 2010 21 Yes

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) 4.07 10.2 -38.37 2 3 1 34 309.861 8

Activity (Go SEA)

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