UCSF

ZINC34472428

Substance Information

In ZINC since Heavy atoms Benign functionality
August 30th, 2009 16 No

Download: MOL2 SDF SMILES Flexibase

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) 2.04 7.01 -39.85 2 3 1 43 260.404 8
Mid Mid (pH 6-8) 2.04 5.96 -7.49 1 3 0 38 259.396 8

Activity (Go SEA)

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