UCSF

ZINC62029792

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 23rd, 2011 21 Yes

Popular Name: (1R)-N-(3-methoxypropyl)-N-methyl-1-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)ethane-1,2-diamine (1R)-N-(3-methoxypropyl)-N-methy…

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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) 1.57 4.5 -45.42 3 4 1 43 292.447 7 ↓
Lo Low (pH 4.5-6) 1.57 5.12 -93.92 4 4 2 45 293.455 7 ↓

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

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