UCSF

ZINC06548294

Substance Information

In ZINC since Heavy atoms Benign functionality
April 6th, 2006 20 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

    None

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) -1.20 4.67 -33.94 3 5 0 94 267.288 3
Lo Low (pH 4.5-6) -1.20 5.15 -74.13 4 5 1 95 268.296 3

Activity (Go SEA)

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