UCSF

ZINC37213828

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 22nd, 2009 20 Yes

Popular Name: (1R)-1-cyclopropyl-N-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]-1-(p-tolyl)methanamine (1R)-1-cyclopropyl-N-[[(2S)-1-et…

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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) 3.79 8.12 -39.07 2 2 1 20 273.444 6 ↓
Mid Mid (pH 6-8) 3.79 9.5 -32.52 2 2 1 16 273.444 6 ↓
Lo Low (pH 4.5-6) 3.79 10.43 -114.03 3 2 2 21 274.452 6 ↓

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

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