UCSF

ZINC20543239

Substance Information

In ZINC since Heavy atoms Benign functionality
November 24th, 2008 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) 3.00 6.45 -10.62 1 6 0 54 355.438 5
Mid Mid (pH 6-8) 3.00 8.69 -42.74 2 6 1 55 356.446 5

Activity (Go SEA)

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