UCSF

ZINC00361245

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 22 No

Other Names:

MFCD03238305

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) 2.36 5.61 -16.8 2 5 0 68 297.358 6
Mid Mid (pH 6-8) 2.36 6.38 -42.3 3 5 0 69 298.366 6

Activity (Go SEA)

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