UCSF

ZINC34477931

Substance Information

In ZINC since Heavy atoms Benign functionality
August 30th, 2009 15 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) 2.50 2.93 -7.99 1 4 0 56 210.229 3
Hi High (pH 8-9.5) 2.50 3.71 -49.2 0 4 -1 59 209.221 3

Activity (Go SEA)

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