UCSF

ZINC20394148

Substance Information

In ZINC since Heavy atoms Benign functionality
November 21st, 2008 19 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) -0.01 1.35 -56.83 4 6 1 80 264.353 3
Lo Low (pH 4.5-6) -0.01 3.73 -138.22 5 6 2 81 265.361 3

Activity (Go SEA)

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