In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 20 | Yes |
Popular Name: 2-(cyclopropylmethylamino)-1-[4-[[(2S)-tetrahydrofuran-2-yl]methyl]piperazin-1-yl]ethanone 2-(cyclopropylmethylamino)-1-[4-…
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) | 0.23 | 4.12 | -43.82 | 2 | 5 | 1 | 49 | 282.408 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.23 | 2.75 | -8.64 | 1 | 5 | 0 | 45 | 281.4 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.23 | 6.34 | -99.41 | 3 | 5 | 2 | 51 | 283.416 | 6 | ↓ |