UCSF

ZINC53433706

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 21st, 2010 17 Yes

Popular Name: N-cyclopropyl-N'-(3-furylmethyl)-N-(2-methoxyethyl)ethane-1,2-diamine N-cyclopropyl-N'-(3-furylmethyl)…

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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) 0.82 4.36 -31.67 2 4 1 39 239.339 9 ↓
Hi High (pH 8-9.5) 0.82 2.38 -3.92 1 4 0 38 238.331 9 ↓
Mid Mid (pH 6-8) 0.82 5.73 -110.76 3 4 2 43 240.347 9 ↓
Mid Mid (pH 6-8) 0.82 3.74 -37.97 2 4 1 42 239.339 9 ↓

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

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