UCSF

ZINC23397983

Substance Information

In ZINC since Heavy atoms Benign functionality
December 31st, 2008 24 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) 2.37 1.5 -19.53 2 7 0 102 370.452 7
Hi High (pH 8-9.5) 2.37 1.57 -46.93 1 7 -1 104 369.444 7

Activity (Go SEA)

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