UCSF

ZINC06393298

Substance Information

In ZINC since Heavy atoms Benign functionality
March 26th, 2006 22 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) 2.08 6.21 -58.41 1 6 -1 99 321.378 4
Hi High (pH 8-9.5) 2.08 5.81 -109.68 0 6 -2 101 320.37 4

Activity (Go SEA)

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