UCSF

ZINC34684581

Substance Information

In ZINC since Heavy atoms Benign functionality
September 22nd, 2009 26 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) 3.85 8.53 -10.41 1 4 0 36 371.912 5
Mid Mid (pH 6-8) 3.85 10.74 -47.42 2 4 1 37 372.92 5

Activity (Go SEA)

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