UCSF

ZINC20475011

Substance Information

In ZINC since Heavy atoms Benign functionality
November 22nd, 2008 14 No

Other Names:

MFCD08556860

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) 0.47 4.8 -33.08 2 3 0 57 294.195 2
Hi High (pH 8-9.5) 0.47 3.51 -40.5 1 3 -1 52 293.187 2

Activity (Go SEA)

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