UCSF

ZINC34684293

Substance Information

In ZINC since Heavy atoms Benign functionality
September 22nd, 2009 28 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) 1.44 3.17 -10.79 0 8 0 71 386.452 5
Mid Mid (pH 6-8) 1.44 5.44 -53.69 1 8 1 72 387.46 5

Activity (Go SEA)

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