UCSF

ZINC20732305

Substance Information

In ZINC since Heavy atoms Benign functionality
November 27th, 2008 30 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) 1.47 6.74 -18.83 1 9 0 104 427.486 5
Ref Reference (pH 7) 1.28 9.15 -17.31 1 9 0 100 427.486 5

Activity (Go SEA)

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