UCSF

ZINC20122251

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 16th, 2008 16 Yes

Popular Name: (1S)-N'-[(1S)-1-cyclopropylethyl]-1-(2-furyl)-N,N-dimethyl-ethane-1,2-diamine (1S)-N'-[(1S)-1-cyclopropylethyl…

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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) 2.17 5.35 -35.59 2 3 1 33 223.34 6 ↓
Mid Mid (pH 6-8) 2.17 7.56 -118.43 3 3 2 34 224.348 6 ↓
Mid Mid (pH 6-8) 2.17 6.07 -34.3 2 3 1 30 223.34 6 ↓

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

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