UCSF

ZINC04813662

Substance Information

In ZINC since Heavy atoms Benign functionality
January 5th, 2006 24 No

Other Names:

MFCD00994480

MFCD01419750

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) 5.00 8.58 -11.04 1 5 0 59 339.42 5
Ref Reference (pH 7) 5.00 8.59 -10.88 1 5 0 59 339.42 5
Lo Low (pH 4.5-6) 4.07 8.74 -31.69 2 5 1 57 340.428 6

Activity (Go SEA)

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