In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 21st, 2009 | 27 | Yes |
Popular Name: N-[(2S)-2-(3,4-dihydro-1H-isoquinolin-2-yl)butyl]-3-(3-methoxyphenyl)propanamide N-[(2S)-2-(3,4-dihydro-1H-isoqui…
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) | 4.06 | 11.18 | -48.49 | 2 | 4 | 1 | 43 | 367.513 | 8 | ↓ |
Mid Mid (pH 6-8) | 4.06 | 8.99 | -9.9 | 1 | 4 | 0 | 42 | 366.505 | 8 | ↓ |