UCSF

ZINC25509526

Substance Information

In ZINC since Heavy atoms Benign functionality
January 29th, 2009 24 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 3.03 9.75 -48.28 2 5 1 60 337.415 6
Hi High (pH 8-9.5) 3.03 7.4 -15.63 1 5 0 59 336.407 6

Activity (Go SEA)

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