In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2011 | 21 | Yes |
Popular Name: [(2R,3S)-4-isopropyl-3-(8-quinolyl)morpholin-2-yl]methanamine [(2R,3S)-4-isopropyl-3-(8-quinol…
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) | 1.19 | 3.7 | -41.21 | 3 | 4 | 1 | 53 | 286.399 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.19 | 3.33 | -7.39 | 2 | 4 | 0 | 51 | 285.391 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.