UCSF

ZINC05126433

Substance Information

In ZINC since Heavy atoms Benign functionality
January 22nd, 2006 26 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) 2.67 -2.01 -13.72 1 9 0 119 382.394 7
Hi High (pH 8-9.5) 2.67 -1.43 -41.19 0 9 -1 121 381.386 7

Activity (Go SEA)

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