UCSF

ZINC25931217

Substance Information

In ZINC since Heavy atoms Benign functionality
February 2nd, 2009 23 No

Download: MOL2 SDF SMILES Flexibase

Annotations

None

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) 2.10 6.06 -13.59 2 6 0 92 313.357 8
Lo Low (pH 4.5-6) 2.10 8.17 -60.48 3 6 1 93 314.365 8

Activity (Go SEA)

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