UCSF

ZINC00173910

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 19 Yes

Other Names:

MFCD18430654

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) 0.88 6.26 -50.44 3 3 1 46 258.341 5
Hi High (pH 8-9.5) 0.88 5.97 -7.12 2 3 0 44 257.333 5

Activity (Go SEA)

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