In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 16 | Yes |
Popular Name: 2-[[3-(aminomethyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl]-methyl-amino]ethanol 2-[[3-(aminomethyl)-6,7-dihydro-…
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) | 0.52 | 2.71 | -94.15 | 5 | 4 | 2 | 65 | 223.32 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.52 | 2.16 | -48.05 | 4 | 4 | 1 | 64 | 222.312 | 4 | ↓ |