UCSF

ZINC33985718

Substance Information

In ZINC since Heavy atoms Benign functionality
August 6th, 2009 31 No

Download: MOL2 SDF SMILES Flexibase

Annotations

None

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) -5.46 -0.61 -240.32 4 15 -2 232 486.311 9
Mid Mid (pH 6-8) -5.46 -1.76 -130.77 5 15 -1 230 487.319 9

Activity (Go SEA)

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