UCSF

ZINC26423555

Substance Information

In ZINC since Heavy atoms Benign functionality
February 6th, 2009 17 Yes

Other Names:

MFCD16653136

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) 0.90 5.61 -77.9 2 4 1 47 237.323 3
Hi High (pH 8-9.5) 1.81 5.21 -49.09 1 4 0 50 236.315 3

Activity (Go SEA)

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