UCSF

ZINC12815869

Substance Information

In ZINC since Heavy atoms Benign functionality
May 22nd, 2008 26 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) 2.11 5.15 -20.46 3 7 0 96 352.394 8
Lo Low (pH 4.5-6) 2.11 5.62 -44.03 4 7 1 97 353.402 8

Activity (Go SEA)

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