In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 26th, 2010 | 20 | Yes |
Popular Name: 1-[(1-methylcyclopentyl)amino]isoquinoline-3-carboxylic 1-[(1-methylcyclopentyl)amino]is…
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) | 3.91 | 9.46 | -33.98 | 2 | 4 | 0 | 66 | 270.332 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.91 | 9.26 | -61.16 | 1 | 4 | -1 | 65 | 269.324 | 3 | ↓ |