UCSF

ZINC05245577

Substance Information

In ZINC since Heavy atoms Benign functionality
January 27th, 2006 20 Yes

Other Names:

MFCD06774399

Download: MOL2 SDF SMILES Flexibase

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) 1.42 -2.79 -53.85 4 5 1 78 299.778 8

Activity (Go SEA)

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