UCSF

ZINC67974373

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 18th, 2011 25 Yes

Popular Name: 4-[(2R)-2-(aminomethyl)-1,2-dihydrobenzo[e]benzofuran-7-yl]-2-methoxy-pyridine-3-carbonitrile 4-[(2R)-2-(aminomethyl)-1,2-dihy…

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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) 2.50 5.24 -52.98 3 5 1 83 332.383 3 ↓
Hi High (pH 8-9.5) 2.50 4.81 -13.02 2 5 0 81 331.375 3 ↓

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

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