In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 15 | Yes |
Popular Name: 3-(aminomethyl)-N-methyl-N-[(2S)-2-methylbutyl]pyridin-2-amine 3-(aminomethyl)-N-methyl-N-[(2S)…
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) | 1.90 | 5.88 | -45.97 | 3 | 3 | 1 | 44 | 208.329 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.90 | 5.48 | -3.58 | 2 | 3 | 0 | 42 | 207.321 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.90 | 6.2 | -99.63 | 4 | 3 | 2 | 45 | 209.337 | 5 | ↓ |