In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 20 | Yes |
Popular Name: 3-(aminomethyl)-N-isobutyl-N-(2-methoxyethyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-2-amine 3-(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) | 2.26 | 6.89 | -95.7 | 4 | 4 | 2 | 54 | 279.428 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.26 | 7.02 | -46.98 | 3 | 4 | 1 | 53 | 278.42 | 7 | ↓ |