UCSF

ZINC47385380

Substance Information

In ZINC since Heavy atoms Benign functionality
August 27th, 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) 2.00 7.95 -13.77 1 6 0 69 308.341 4
Lo Low (pH 4.5-6) 2.00 8.41 -34.07 2 6 1 70 309.349 4

Activity (Go SEA)

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