UCSF

ZINC20360391

Substance Information

In ZINC since Heavy atoms Benign functionality
November 20th, 2008 18 No

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) 2.24 6.51 -10.84 1 4 0 45 267.76 3
Mid Mid (pH 6-8) 2.24 6.84 -35.66 2 4 1 46 268.768 3

Activity (Go SEA)

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