UCSF

ZINC34685865

Substance Information

In ZINC since Heavy atoms Benign functionality
September 22nd, 2009 25 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) 1.48 4.99 -40.79 2 7 1 58 349.455 4
Hi High (pH 8-9.5) 1.48 2.63 -9.93 1 7 0 57 348.447 4

Activity (Go SEA)

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