UCSF

ZINC03911573

Substance Information

In ZINC since Heavy atoms Benign functionality
October 17th, 2005 26 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

    None

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) 3.90 10.33 -16.73 2 6 0 72 346.39 4
Lo Low (pH 4.5-6) 3.90 10.7 -31.94 3 6 1 73 347.398 4

Activity (Go SEA)

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