UCSF

ZINC37048022

Substance Information

In ZINC since Heavy atoms Benign functionality
November 19th, 2009 18 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) 0.03 0 -49.62 2 7 -1 116 274.274 6
Hi High (pH 8-9.5) 0.03 0.04 -99.39 1 7 -2 118 273.266 6

Activity (Go SEA)

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