In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 21 | Yes |
Popular Name: 3-(aminomethyl)-N-isopropyl-N-(2-thienylmethyl)-6,7-dihydro-5H-cyclopenta[b]pyridin-2-amine 3-(aminomethyl)-N-isopropyl-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) | 3.12 | 8.96 | -104.36 | 4 | 3 | 2 | 45 | 303.475 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.12 | 8.44 | -52.83 | 3 | 3 | 1 | 44 | 302.467 | 5 | ↓ |