UCSF

ZINC06024138

Substance Information

In ZINC since Heavy atoms Benign functionality
March 1st, 2006 31 No

Other Names:

MFCD03213513

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) 4.71 11.29 -56.89 0 5 -1 74 418.444 6
Lo Low (pH 4.5-6) 4.71 10.46 -14.35 1 5 0 71 419.452 6

Activity (Go SEA)

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