UCSF

ZINC52830988

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 14th, 2010 14 Yes

Popular Name: N-[2-[(2S)-tetrahydrofuran-2-yl]ethyl]pyridazin-3-amine N-[2-[(2S)-tetrahydrofuran-2-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) 0.47 3.27 -8.22 1 4 0 47 193.25 4 ↓
Mid Mid (pH 6-8) 0.47 3.43 -31.08 2 4 1 48 194.258 4 ↓
Mid Mid (pH 6-8) 0.47 3.45 -28.07 2 4 1 48 194.258 4 ↓

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Rings

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

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