UCSF

ZINC26578959

Substance Information

In ZINC since Heavy atoms Benign functionality
February 8th, 2009 43 No

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) 5.00 13.05 -16.35 1 10 0 134 597.705 10
Lo Low (pH 4.5-6) 5.00 13.52 -50.14 2 10 1 136 598.713 10

Activity (Go SEA)

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