In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 19 | Yes |
Popular Name: (3R)-1-isopropyl-N-[3-[(2S)-2-methyl-1-piperidyl]propyl]pyrrolidin-3-amine (3R)-1-isopropyl-N-[3-[(2S)-2-me…
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) | 2.46 | 7.12 | -103.09 | 3 | 3 | 2 | 24 | 269.477 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.46 | 5.01 | -38.22 | 2 | 3 | 1 | 23 | 268.469 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.46 | 8.3 | -75.84 | 3 | 3 | 2 | 21 | 269.477 | 6 | ↓ |