UCSF

ZINC22684032

Substance Information

In ZINC since Heavy atoms Benign functionality
December 19th, 2008 28 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) 4.78 13.57 -44.53 2 3 1 34 415.648 7
Hi High (pH 8-9.5) 4.78 11.47 -9.99 1 3 0 32 414.64 7

Activity (Go SEA)

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