UCSF

ZINC16960176

Substance Information

In ZINC since Heavy atoms Benign functionality
September 11th, 2008 22 Yes

Other Names:

MFCD00488515

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) 3.20 3.02 -27.84 3 5 1 79 295.318 3
Ref Reference (pH 7) 3.20 3.94 -27.82 3 5 1 79 295.318 3

Activity (Go SEA)

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