UCSF

ZINC67514810

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 10th, 2011 21 Yes

Popular Name: [(2R)-7-pyrazin-2-yl-1,2-dihydrobenzo[e]benzofuran-2-yl]methanamine [(2R)-7-pyrazin-2-yl-1,2-dihydro…

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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) 1.88 4.75 -51.74 3 4 1 63 278.335 2 ↓
Hi High (pH 8-9.5) 1.88 4.38 -8.81 2 4 0 61 277.327 2 ↓

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

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