UCSF

ZINC09123784

Substance Information

In ZINC since Heavy atoms Benign functionality
August 8th, 2007 27 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 0.90 -0.87 -52.06 1 9 1 84 380.469 6
Mid Mid (pH 6-8) 0.90 -0.65 -130.97 2 9 2 85 381.477 6

Activity (Go SEA)

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