In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 17th, 2010 | 19 | Yes |
Popular Name: (1R,5S)-N-isopropyl-8-methyl-3-(4-methylthiazol-2-yl)-8-azabicyclo[3.2.1]octan-3-amine (1R,5S)-N-isopropyl-8-methyl-3-(…
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) | 2.12 | 4.7 | -27.02 | 2 | 3 | 1 | 33 | 280.461 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.12 | 7.8 | -33.28 | 2 | 3 | 1 | 29 | 280.461 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.12 | 7.06 | -96.51 | 3 | 3 | 2 | 34 | 281.469 | 3 | ↓ |