UCSF

ZINC37841054

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 2nd, 2009 21 Yes

Popular Name: (3,5-dimethyl-1H-pyrazol-4-yl)-[4-[[(2R)-tetrahydrofuran-2-yl]methyl]piperazin-1-yl]methanone (3,5-dimethyl-1H-pyrazol-4-yl)-[…

Find On: PubMed — Wikipedia — Google

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) -0.08 2.9 -10.48 1 6 0 61 292.383 3 ↓
Mid Mid (pH 6-8) -0.08 5.11 -44.86 2 6 1 63 293.391 3 ↓

Activity (Go SEA)

Rings

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