UCSF

ZINC16692652

Substance Information

In ZINC since Heavy atoms Benign functionality
September 5th, 2008 27 No

Other Names:

MFCD01921626

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) 4.95 7.9 -10.65 1 6 0 73 404.875 5
Ref Reference (pH 7) 4.95 7.5 -10.25 1 6 0 73 404.875 5
Ref Reference (pH 7) 4.46 7.35 -38.78 0 6 -1 72 403.867 6

Activity (Go SEA)

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