UCSF

ZINC34684196

Substance Information

In ZINC since Heavy atoms Benign functionality
September 22nd, 2009 22 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) 1.75 4.56 -8.26 1 5 0 45 305.422 6
Mid Mid (pH 6-8) 1.75 4.55 -32.39 2 5 1 46 306.43 6

Activity (Go SEA)

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