UCSF

ZINC27515444

Substance Information

In ZINC since Heavy atoms Benign functionality
February 16th, 2009 25 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) 4.79 11.71 -20.04 0 4 0 46 352.459 3
Lo Low (pH 4.5-6) 4.79 12.64 -31.01 1 4 1 48 353.467 3

Activity (Go SEA)

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