UCSF

ZINC26492898

Substance Information

In ZINC since Heavy atoms Benign functionality
February 7th, 2009 20 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) 1.88 2.38 -11.78 2 5 0 67 268.272 0
Hi High (pH 8-9.5) 2.07 0.59 -47.63 1 5 -1 74 267.264 0

Activity (Go SEA)

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