UCSF

ZINC35021115

Substance Information

In ZINC since Heavy atoms Benign functionality
October 2nd, 2009 15 Yes

Other Names:

MFCD09800919

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) 2.68 8.23 -36.55 1 2 1 22 269.162 3
Hi High (pH 8-9.5) 2.68 5.86 -5.54 0 2 0 20 268.154 3

Activity (Go SEA)

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