UCSF

ZINC53437777

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 21st, 2010 19 Yes

Popular Name: N-[(1R)-1-cyclopropylethyl]-N'-(3-furylmethyl)-N-(2-methoxyethyl)ethane-1,2-diamine N-[(1R)-1-cyclopropylethyl]-N'-(…

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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) 1.66 5.25 -31.48 2 4 1 39 267.393 10 ↓
Hi High (pH 8-9.5) 1.66 3.42 -4.18 1 4 0 38 266.385 10 ↓
Mid Mid (pH 6-8) 1.66 6.6 -111.52 3 4 2 43 268.401 10 ↓
Mid Mid (pH 6-8) 1.66 4.77 -40.05 2 4 1 42 267.393 10 ↓

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

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