UCSF

ZINC69989921

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 1st, 2011 20 Yes

Popular Name: N-[(1S)-2-(1-isopropylpyrazol-3-yl)-1-pyrazin-2-yl-ethyl]propan-1-amine N-[(1S)-2-(1-isopropylpyrazol-3-…

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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) 2.32 6.03 -32.09 2 5 1 60 274.392 7 ↓
Mid Mid (pH 6-8) 2.32 4.71 -7.64 1 5 0 56 273.384 7 ↓

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

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