UCSF

ZINC01532771

Substance Information

In ZINC since Heavy atoms Benign functionality
November 7th, 2005 17 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) -3.43 -4.53 -82.76 5 7 0 125 240.263 7
Mid Mid (pH 6-8) -3.43 -3.94 -110.99 6 7 1 126 241.271 7

Activity (Go SEA)

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