UCSF

ZINC40165650

Substance Information

In ZINC since Heavy atoms Benign functionality
April 1st, 2010 11 Yes

Other Names:

F1957-0119

MFCD21091452

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) -0.19 0.51 -59.79 3 5 -1 103 153.117 1
Lo Low (pH 4.5-6) -0.19 -0.25 -43.61 4 5 0 101 154.125 1

Activity (Go SEA)

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