UCSF

ZINC34667660

Substance Information

In ZINC since Heavy atoms Benign functionality
September 18th, 2009 31 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) 3.78 11.17 -14.03 1 6 0 66 434.927 4
Lo Low (pH 4.5-6) 3.78 11.52 -44 2 6 1 67 435.935 4

Activity (Go SEA)

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