In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2008 | 19 | Yes |
Popular Name: 2-methyl-N-[(1S)-1-(5-methyl-2-thienyl)ethyl]-2-morpholino-propan-1-amine 2-methyl-N-[(1S)-1-(5-methyl-2-t…
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) | 2.86 | 5.91 | -37.13 | 2 | 3 | 1 | 29 | 283.461 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.86 | 4.17 | -3.06 | 1 | 3 | 0 | 24 | 282.453 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.86 | 7.79 | -115.17 | 3 | 3 | 2 | 30 | 284.469 | 5 | ↓ |