UCSF

ZINC42290512

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 27th, 2010 13 Yes

Popular Name: 3-(3,5-dimethyl-1H-pyrazol-1-yl)piperidine 3-(3,5-dimethyl-1H-pyrazol-1-yl)…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 1250773-31-9 , 1311315-07-7

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) 0.65 4.39 -43.08 2 3 1 34 180.275 1 ↓

Vendor Notes

Note Type Comments Provided By
MP 229 - 231 Enamine Building Blocks
MP 229...231 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

Activity (Go SEA)

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