UCSF

ZINC39643971

Substance Information

In ZINC since Heavy atoms Benign functionality
March 2nd, 2010 16 No

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) 1.24 2.44 -10.03 2 7 0 103 220.188 2
Hi High (pH 8-9.5) 1.69 0.54 -37.45 1 7 -1 106 219.18 2

Activity (Go SEA)

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