UCSF

ZINC26330966

Substance Information

In ZINC since Heavy atoms Benign functionality
February 5th, 2009 24 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) 2.45 7 -56.5 1 8 -1 128 325.256 3
Lo Low (pH 4.5-6) 2.45 6.21 -16.22 2 8 0 125 326.264 3

Activity (Go SEA)

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