UCSF

ZINC37097266

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Substance Information

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

Popular Name: (1R)-N'-cyclopropyl-1-(2-naphthyl)-N'-propyl-ethane-1,2-diamine (1R)-N'-cyclopropyl-1-(2-naphthy…

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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 9.53 -35.78 3 2 1 30 269.412 6 ↓
Mid Mid (pH 6-8) 1.88 9.86 -126.49 4 2 2 32 270.42 6 ↓

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

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