In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 2nd, 2009 | 22 | Yes |
Popular Name: N-[(2S)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-3-methyl-butyl]-2,2-dimethyl-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) | 3.98 | 9.65 | -46.07 | 2 | 3 | 1 | 34 | 303.47 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.98 | 7.48 | -8.55 | 1 | 3 | 0 | 32 | 302.462 | 5 | ↓ |