UCSF

ZINC04270143

Substance Information

In ZINC since Heavy atoms Benign functionality
November 17th, 2005 21 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) 0.57 -2.55 -15.85 1 7 0 90 309.347 3
Hi High (pH 8-9.5) 0.57 -1.97 -48.38 0 7 -1 92 308.339 3

Activity (Go SEA)

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