UCSF

ZINC35127704

Substance Information

In ZINC since Heavy atoms Benign functionality
October 3rd, 2009 17 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) -1.00 0.42 -9.58 2 6 0 83 232.243 3
Lo Low (pH 4.5-6) -1.00 0.89 -41.89 3 6 1 85 233.251 3

Activity (Go SEA)

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