In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2011 | 18 | Yes |
Popular Name: (1R,5S)-3-(aminomethyl)-N-(1,1-dimethylpropyl)-N,8-dimethyl-8-azabicyclo[3.2.1]octan-3-amine (1R,5S)-3-(aminomethyl)-N-(1,1-d…
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) | 1.70 | 3.1 | -26.85 | 3 | 3 | 1 | 34 | 254.442 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.70 | 3.28 | -30.41 | 3 | 3 | 1 | 34 | 254.442 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.70 | 3.52 | -97.37 | 4 | 3 | 2 | 35 | 255.45 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.70 | 5.49 | -200.96 | 5 | 3 | 3 | 37 | 256.458 | 4 | ↓ |