UCSF

ZINC02538874

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 15 Yes

Popular Name: 5-Methyl-1-(2-methyl-benzyl)-1 H -pyrazol-3-ylamine 5-Methyl-1-(2-methyl-benzyl)-1 H…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 956389-77-4 , 956393-77-4

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) 2.21 -0.11 -7.18 2 3 0 44 201.273 2 ↓

Activity (Go SEA)

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

No pre-computed analogs available. Try a structural similarity search.