UCSF

ZINC37055203

Substance Information

In ZINC since Heavy atoms Benign functionality
November 20th, 2009 19 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) 1.21 3.2 -46.17 1 6 -1 96 290.292 7
Hi High (pH 8-9.5) 1.21 3.24 -99.03 0 6 -2 98 289.284 7

Activity (Go SEA)

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