UCSF

ZINC19721348

Substance Information

In ZINC since Heavy atoms Benign functionality
November 7th, 2008 16 Yes

Other Names:

MFCD07700280

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) 1.38 3.88 -85.43 5 3 2 54 217.316 5
Hi High (pH 8-9.5) 1.38 3.46 -53.05 4 3 1 53 216.308 5

Activity (Go SEA)

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