UCSF

ZINC08991526

Substance Information

In ZINC since Heavy atoms Benign functionality
August 3rd, 2007 28 Yes

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) 3.38 1.26 -52.97 1 5 1 56 371.416 3
Lo Low (pH 4.5-6) 3.38 1.32 -131.09 2 5 2 58 372.424 3

Activity (Go SEA)

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