UCSF

ZINC12889360

Substance Information

In ZINC since Heavy atoms Benign functionality
May 22nd, 2008 30 Yes

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) -0.90 5.35 -55.13 3 9 -1 144 410.406 7

Activity (Go SEA)

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