UCSF

ZINC27094287

Substance Information

In ZINC since Heavy atoms Benign functionality
February 13th, 2009 19 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) -1.90 -2.64 -115.08 9 6 2 127 292.449 11
Hi High (pH 8-9.5) -1.90 -2.93 -56.28 8 6 1 126 291.441 11

Activity (Go SEA)

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