UCSF

ZINC35807837

Substance Information

In ZINC since Heavy atoms Benign functionality
October 13th, 2009 32 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) 4.64 8.61 -11.69 1 6 0 64 472.01 10
Lo Low (pH 4.5-6) 4.64 10.39 -64.47 2 6 1 65 473.018 10

Activity (Go SEA)

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