UCSF

ZINC26154313

Substance Information

In ZINC since Heavy atoms Benign functionality
February 4th, 2009 21 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) 1.66 7.82 -9.91 2 5 0 71 304.419 5
Mid Mid (pH 6-8) 1.66 7.78 -13.25 2 5 0 71 304.419 5

Activity (Go SEA)

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