In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 10th, 2010 | 20 | Yes |
Popular Name: (3R)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-phenyl-propan-1-amine (3R)-3-(3,4-dihydro-1H-isoquinol…
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) | 2.39 | 6.67 | -46.69 | 3 | 2 | 1 | 31 | 267.396 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.39 | 8.98 | -115.68 | 4 | 2 | 2 | 32 | 268.404 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.