In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 5th, 2010 | 32 | Yes |
Popular Name: 3-isoquinolyl-[4-[(2S)-2-(morpholine-4-carbonyl)morpholin-4-yl]-1-piperidyl]methanone 3-isoquinolyl-[4-[(2S)-2-(morpho…
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) | 1.40 | 6.45 | -19.41 | 0 | 8 | 0 | 75 | 438.528 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.40 | 8.91 | -58.33 | 1 | 8 | 1 | 76 | 439.536 | 3 | ↓ |