UCSF

ZINC12464762

Substance Information

In ZINC since Heavy atoms Benign functionality
May 16th, 2008 29 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) 3.65 9.52 -29.64 1 8 0 99 480.702 7
Ref Reference (pH 7) 3.65 9.64 -21.04 1 8 0 99 480.702 7

Activity (Go SEA)

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