In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2010 | 17 | Yes |
Popular Name: 6-(aminomethyl)-N-isobutyl-N-(2-methoxyethyl)pyridin-2-amine 6-(aminomethyl)-N-isobutyl-N-(2-…
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) | 1.50 | 4.46 | -40.23 | 3 | 4 | 1 | 53 | 238.355 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.50 | 4.32 | -22.65 | 3 | 4 | 1 | 53 | 238.355 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.50 | 4.42 | -5.25 | 2 | 4 | 0 | 51 | 237.347 | 7 | ↓ |
Lo Low (pH 4.5-6) | 1.50 | 5.11 | -100.51 | 4 | 4 | 2 | 54 | 239.363 | 7 | ↓ |