UCSF

ZINC00035697

Substance Information

In ZINC since Heavy atoms Benign functionality
November 2nd, 2005 20 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) 0.80 7.77 -51.03 1 5 1 55 273.312 1
Mid Mid (pH 6-8) 0.80 5.42 -17.28 0 5 0 54 272.304 1

Activity (Go SEA)

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