UCSF

ZINC41567470

Substance Information

In ZINC since Heavy atoms Benign functionality
April 20th, 2010 23 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 2.01 7.25 -10.79 1 4 0 55 307.328 4
Lo Low (pH 4.5-6) 2.01 7.7 -38.45 2 4 1 56 308.336 4

Activity (Go SEA)

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