UCSF

ZINC26511386

Substance Information

In ZINC since Heavy atoms Benign functionality
February 7th, 2009 19 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) 3.95 7.27 -8.13 3 3 0 55 269.735 2
Lo Low (pH 4.5-6) 3.95 7.33 -32.12 4 3 1 56 270.743 2

Activity (Go SEA)

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