UCSF

ZINC33734695

Substance Information

In ZINC since Heavy atoms Benign functionality
July 17th, 2009 35 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) 4.71 13.36 -39.28 1 7 1 70 501.669 10
Hi High (pH 8-9.5) 4.71 11.32 -13.45 0 7 0 68 500.661 10

Activity (Go SEA)

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