UCSF

ZINC52480852

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 10th, 2010 18 Yes

Popular Name: (2R)-N1-cyclopropyl-N2,3-dimethyl-N2-(4-pyridylmethyl)butane-1,2-diamine (2R)-N1-cyclopropyl-N2,3-dimethy…

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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) 1.71 5.87 -37.83 2 3 1 33 248.394 7 ↓
Hi High (pH 8-9.5) 1.71 7.83 -35.37 2 3 1 29 248.394 7 ↓

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

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