UCSF

ZINC34681480

Substance Information

In ZINC since Heavy atoms Benign functionality
September 22nd, 2009 34 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) 5.12 11.37 -12.46 1 6 0 58 470.598 7
Mid Mid (pH 6-8) 5.12 13.59 -49.05 2 6 1 59 471.606 7

Activity (Go SEA)

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