UCSF

ZINC38277043

Substance Information

In ZINC since Heavy atoms Benign functionality
January 13th, 2010 19 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) -4.65 -7.3 -85.13 7 10 0 175 276.249 8
Mid Mid (pH 6-8) -4.65 -7.66 -56.65 6 10 -1 174 275.241 8

Activity (Go SEA)

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