UCSF

ZINC34936244

Substance Information

In ZINC since Heavy atoms Benign functionality
October 1st, 2009 20 Yes

Other Names:

MFCD11987148

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) 0.69 5.19 -97.51 4 4 2 39 276.428 3
Mid Mid (pH 6-8) 0.69 2.83 -44.65 3 4 1 37 275.42 3

Activity (Go SEA)

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