In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2010 | 19 | Yes |
Popular Name: (1R)-1-(2,5-dimethylphenyl)-N-ethyl-2-(2-pyridyl)ethanamine (1R)-1-(2,5-dimethylphenyl)-N-et…
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) | 3.51 | 9.61 | -29.12 | 2 | 2 | 1 | 29 | 255.385 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.51 | 8.58 | -4.12 | 1 | 2 | 0 | 25 | 254.377 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.51 | 9.3 | -102.95 | 3 | 2 | 2 | 31 | 256.393 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.