UCSF

ZINC05718514

Substance Information

In ZINC since Heavy atoms Benign functionality
February 10th, 2006 26 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) 5.18 7.15 -9.88 2 5 0 75 368.458 4
Hi High (pH 8-9.5) 5.64 5.11 -49.02 1 5 -1 78 367.45 4

Activity (Go SEA)

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