UCSF

ZINC34395856

Substance Information

In ZINC since Heavy atoms Benign functionality
August 28th, 2009 18 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) 3.41 4.83 -8.32 1 4 0 56 246.262 4
Hi High (pH 8-9.5) 3.41 5.59 -48.9 0 4 -1 59 245.254 4

Activity (Go SEA)

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