UCSF

ZINC20469564

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 22nd, 2008 14 Yes

Popular Name: 4-(aminomethyl)-N,N-diethyl-2,5-dimethyl-pyrazol-3-amine 4-(aminomethyl)-N,N-diethyl-2,5-…

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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) 0.70 2.17 -42.53 3 4 1 49 197.306 4 ↓
Lo Low (pH 4.5-6) 0.70 2.28 -94.64 4 4 2 50 198.314 4 ↓

Activity (Go SEA)

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