In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 23rd, 2011 | 17 | Yes |
Popular Name: (3S)-3-(aminomethyl)-N-(3-methoxypropyl)-N-methyl-quinuclidin-3-amine (3S)-3-(aminomethyl)-N-(3-methox…
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) | 0.12 | -0.77 | -42.47 | 3 | 4 | 1 | 43 | 242.387 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.12 | 2.34 | -34.96 | 3 | 4 | 1 | 43 | 242.387 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.12 | 1.66 | -108.26 | 4 | 4 | 2 | 45 | 243.395 | 6 | ↓ |