UCSF

ZINC22910994

Substance Information

In ZINC since Heavy atoms Benign functionality
December 22nd, 2008 14 Yes

Other Names:

MFCD09894145

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) 0.60 3.54 -87.76 3 3 2 24 201.358 4
Lo Low (pH 4.5-6) 0.60 5.67 -189.02 4 3 3 25 202.366 4

Activity (Go SEA)

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