UCSF

ZINC34835368

Substance Information

In ZINC since Heavy atoms Benign functionality
September 29th, 2009 19 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) 5.33 9.44 -31.29 2 2 1 26 284.851 9
Hi High (pH 8-9.5) 5.33 7.99 -2.95 1 2 0 21 283.843 9

Activity (Go SEA)

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