UCSF

ZINC34827022

Substance Information

In ZINC since Heavy atoms Benign functionality
September 29th, 2009 25 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) -0.04 -5.62 -82.9 9 7 2 134 362.511 10
Hi High (pH 8-9.5) -0.04 -6.96 -42.12 8 7 1 130 361.503 10

Activity (Go SEA)

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