UCSF

ZINC22913520

Substance Information

In ZINC since Heavy atoms Benign functionality
December 22nd, 2008 15 Yes

Other Names:

MFCD07368744

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) 1.94 4.36 -40.28 2 2 1 20 274.157 2
Hi High (pH 8-9.5) 1.94 3.02 -3.21 1 2 0 15 273.149 2

Activity (Go SEA)

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