UCSF

ZINC02680199

Substance Information

In ZINC since Heavy atoms Benign functionality
October 3rd, 2005 26 No

Other Names:

MFCD00706242

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) 3.27 -2.53 -15.23 3 8 0 123 370.39 5
Lo Low (pH 4.5-6) 3.27 -2.42 -50.84 3 8 1 123 370.39 5

Activity (Go SEA)

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