UCSF

ZINC35017363

Substance Information

In ZINC since Heavy atoms Benign functionality
October 2nd, 2009 32 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) 2.90 11.12 -20.8 2 10 0 121 484.914 10
Mid Mid (pH 6-8) 2.15 9.86 -41.83 1 10 -1 128 483.906 9

Activity (Go SEA)

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