UCSF

ZINC00740032

Substance Information

In ZINC since Heavy atoms Benign functionality
July 25th, 2004 34 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) 4.60 11.3 -9.78 2 6 0 65 456.59 6
Lo Low (pH 4.5-6) 4.60 13.02 -46.67 3 6 1 66 457.598 6

Activity (Go SEA)

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