UCSF

ZINC20757708

Substance Information

In ZINC since Heavy atoms Benign functionality
November 28th, 2008 21 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) 1.83 4.33 -11.85 0 6 0 49 287.319 2

Activity (Go SEA)

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