UCSF

ZINC70335518

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 10th, 2011 20 Yes

Popular Name: (2R)-2-(cyclopropylamino)-2-methyl-3-(4-methyl-2,3-dihydroquinoxalin-1-yl)propan-1-ol (2R)-2-(cyclopropylamino)-2-meth…

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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) 1.91 4.81 -28.44 3 4 1 43 276.404 5 ↓
Hi High (pH 8-9.5) 1.91 3.64 -5.5 2 4 0 39 275.396 5 ↓
Mid Mid (pH 6-8) 1.91 5.43 -88.43 4 4 2 45 277.412 5 ↓

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

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