UCSF

ZINC55639773

Substance Information

In ZINC since Heavy atoms Benign functionality
December 18th, 2010 28 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) 4.09 11.2 -18.34 2 6 0 72 396.516 7
Mid Mid (pH 6-8) 4.82 11.35 -56.47 1 6 -1 69 395.508 7

Activity (Go SEA)

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