In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 29th, 2009 | 24 | Yes |
Popular Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-propyl]-3-(3-thienyl)propanamide N-[2-(3,4-dihydro-1H-isoquinolin…
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) | 3.56 | 10.37 | -41.31 | 2 | 3 | 1 | 34 | 343.516 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.56 | 8.27 | -7.52 | 1 | 3 | 0 | 32 | 342.508 | 6 | ↓ |