UCSF

ZINC00663268

Substance Information

In ZINC since Heavy atoms Benign functionality
July 25th, 2004 27 Yes

Other Names:

MFCD03697769

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) 4.63 -3.49 -12.88 3 5 0 80 415.305 3
Lo Low (pH 4.5-6) 4.63 -3.37 -37.89 4 5 1 82 416.313 3

Activity (Go SEA)

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