UCSF

ZINC34684613

Substance Information

In ZINC since Heavy atoms Benign functionality
September 22nd, 2009 24 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) 3.74 7.6 -9.21 1 4 0 36 343.858 4
Lo Low (pH 4.5-6) 3.74 9.77 -43.4 2 4 1 37 344.866 4

Activity (Go SEA)

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