UCSF

ZINC00278001

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 16 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) -3.01 5.08 -28.99 2 4 1 56 235.336 2
Lo Low (pH 4.5-6) -3.01 5.53 -84.78 3 4 2 57 236.344 2

Activity (Go SEA)

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