UCSF

ZINC20611751

Substance Information

In ZINC since Heavy atoms Benign functionality
November 26th, 2008 24 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) 2.96 6.72 -10.18 1 4 0 50 323.44 6

Activity (Go SEA)

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