In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 9th, 2010 | 23 | Yes |
Popular Name: 3-amino-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]pyrazine-2-carboxamide 3-amino-N-[3-(3,4-dihydro-1H-iso…
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) | 0.96 | 5.24 | -45.88 | 4 | 6 | 1 | 85 | 312.397 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.96 | 2.97 | -8.83 | 3 | 6 | 0 | 84 | 311.389 | 5 | ↓ |