UCSF

ZINC34680532

Substance Information

In ZINC since Heavy atoms Benign functionality
September 22nd, 2009 24 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

    None

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) 2.02 7.36 -49.48 3 5 1 62 333.362 3
Lo Low (pH 4.5-6) 2.02 7.68 -102.96 4 5 2 63 334.37 3

Activity (Go SEA)

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