In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 20 | Yes |
Popular Name: 3-(aminomethyl)-N-methyl-N-(3-pyridylmethyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-2-amine 3-(aminomethyl)-N-methyl-N-(3-py…
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) | 1.31 | 6.87 | -105.5 | 4 | 4 | 2 | 58 | 270.38 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.31 | 6.43 | -54.34 | 3 | 4 | 1 | 57 | 269.372 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.31 | 7.32 | -178.96 | 5 | 4 | 3 | 59 | 271.388 | 4 | ↓ |