UCSF

ZINC36769661

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 14th, 2009 19 Yes

Popular Name: (1R,2S)-2-[(2S)-2-ethylmorpholin-4-yl]-1-(p-tolyl)propan-1-amine (1R,2S)-2-[(2S)-2-ethylmorpholin…

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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) 0.95 4.58 -47.16 3 3 1 40 263.405 4 ↓
Hi High (pH 8-9.5) 0.95 4.3 -2.71 2 3 0 38 262.397 4 ↓
Lo Low (pH 4.5-6) 0.95 6.46 -118.25 4 3 2 41 264.413 4 ↓

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