UCSF

ZINC37284870

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 23rd, 2009 20 Yes

Popular Name: (2R)-N-(quinoxalin-2-ylmethyl)-1-(2-thienyl)propan-2-amine (2R)-N-(quinoxalin-2-ylmethyl)-1…

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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) 3.57 5.92 -7.1 1 3 0 38 283.4 5 ↓
Lo Low (pH 4.5-6) 3.57 7.04 -41.7 2 3 1 42 284.408 5 ↓

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

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