In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 18 | Yes |
Popular Name: 3-(aminomethyl)-N,4,6-trimethyl-N-[[(2S)-tetrahydrofuran-2-yl]methyl]pyridin-2-amine 3-(aminomethyl)-N,4,6-trimethyl-…
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) | 1.47 | 5.5 | -97.48 | 4 | 4 | 2 | 54 | 251.374 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.47 | 5.06 | -22.53 | 3 | 4 | 1 | 53 | 250.366 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.47 | 5.02 | -50.06 | 3 | 4 | 1 | 53 | 250.366 | 4 | ↓ |