In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2010 | 17 | Yes |
Popular Name: 2-[(3R)-3-methylmorpholin-4-yl]-N-[(5-methyl-2-thienyl)methyl]ethanamine 2-[(3R)-3-methylmorpholin-4-yl]-…
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) | 1.82 | 4.29 | -42.28 | 2 | 3 | 1 | 29 | 255.407 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.82 | 2.94 | -4 | 1 | 3 | 0 | 24 | 254.399 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.82 | 5.12 | -35.08 | 2 | 3 | 1 | 26 | 255.407 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.82 | 6.46 | -118.3 | 3 | 3 | 2 | 30 | 256.415 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.