UCSF

ZINC11616978

Substance Information

In ZINC since Heavy atoms Benign functionality
March 1st, 2008 26 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) -0.33 -4.82 -67.63 3 10 -1 150 396.43 5
Lo Low (pH 4.5-6) -0.33 -4.72 -72.14 4 10 0 151 397.438 5

Activity (Go SEA)

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