UCSF

ZINC19424775

Substance Information

In ZINC since Heavy atoms Benign functionality
November 1st, 2008 19 No

Download: MOL2 SDF SMILES Flexibase

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) 0.93 4.79 -65.18 4 5 1 69 282.389 7
Hi High (pH 8-9.5) 0.93 2.25 -28.36 3 5 0 68 281.381 7

Activity (Go SEA)

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