UCSF

ZINC08748686

Substance Information

In ZINC since Heavy atoms Benign functionality
July 26th, 2007 30 Yes

Other Names:

MFCD08728341

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) 4.75 -4.73 -13.38 4 5 0 83 432.574 5
Lo Low (pH 4.5-6) 4.75 -4.7 -38.94 5 5 1 85 433.582 5

Activity (Go SEA)

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