UCSF

ZINC34668615

Substance Information

In ZINC since Heavy atoms Benign functionality
September 18th, 2009 24 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) 2.62 8.15 -48.3 2 5 1 50 348.854 6
Mid Mid (pH 6-8) 2.62 5.93 -9.74 1 5 0 49 347.846 6

Activity (Go SEA)

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