UCSF

ZINC13207155

Substance Information

In ZINC since Heavy atoms Benign functionality
June 11th, 2008 24 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) 2.04 6.91 -43.74 2 5 1 68 323.372 3
Lo Low (pH 4.5-6) 2.04 7.32 -96.76 3 5 2 69 324.38 3

Activity (Go SEA)

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