UCSF

ZINC22065916

Substance Information

In ZINC since Heavy atoms Benign functionality
December 12th, 2008 11 Yes

Other Names:

MFCD07784427

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) 1.58 4.65 -7.56 0 3 0 35 152.197 1
Lo Low (pH 4.5-6) 1.58 5.13 -39.08 1 3 1 36 153.205 1

Activity (Go SEA)

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