UCSF

ZINC00661106

Substance Information

In ZINC since Heavy atoms Benign functionality
July 25th, 2004 26 Yes

Other Names:

MFCD03296156

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) 4.65 -4.1 -10.58 3 4 0 68 397.55 4
Lo Low (pH 4.5-6) 4.65 -3.95 -34.02 4 4 1 69 398.558 4

Activity (Go SEA)

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