UCSF

ZINC25757832

Substance Information

In ZINC since Heavy atoms Benign functionality
February 1st, 2009 28 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) -4.89 3.6 -192.53 3 11 -3 194 394.36 13
Lo Low (pH 4.5-6) -4.89 5.34 -121.79 4 11 -2 195 395.368 13

Activity (Go SEA)

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