UCSF

ZINC52503445

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 10th, 2010 18 Yes

Popular Name: (2R)-N1,N2-dicyclopropyl-3-methyl-N2-(2,2,2-trifluoroethyl)butane-1,2-diamine (2R)-N1,N2-dicyclopropyl-3-methy…

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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) 2.89 8.79 -106.53 3 2 2 21 266.351 8 ↓
Hi High (pH 8-9.5) 2.89 5.97 -0.99 1 2 0 15 264.335 8 ↓
Mid Mid (pH 6-8) 2.89 6.84 -39.07 2 2 1 20 265.343 8 ↓

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

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