UCSF

ZINC20609931

Substance Information

In ZINC since Heavy atoms Benign functionality
November 26th, 2008 38 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) 2.79 8.94 -15.37 1 9 0 95 516.598 7

Activity (Go SEA)

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