In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2010 | 18 | Yes |
Popular Name: 6-(aminomethyl)-N-[(3-chlorophenyl)methyl]-N-methyl-pyridin-2-amine 6-(aminomethyl)-N-[(3-chlorophen…
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) | 2.45 | 6.93 | -42.85 | 3 | 3 | 1 | 44 | 262.764 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.45 | 6.53 | -6.05 | 2 | 3 | 0 | 42 | 261.756 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.45 | 6.49 | -27.23 | 3 | 3 | 1 | 43 | 262.764 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.45 | 6.88 | -107.11 | 4 | 3 | 2 | 45 | 263.772 | 4 | ↓ |