In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 5th, 2010 | 17 | Yes |
Popular Name: (1S)-N-[[(2R)-tetrahydropyran-2-yl]methyl]-1-(2-thienyl)butan-1-amine (1S)-N-[[(2R)-tetrahydropyran-2-…
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) | 3.90 | 7.69 | -34.78 | 2 | 2 | 1 | 26 | 254.419 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.90 | 6.68 | -2.57 | 1 | 2 | 0 | 21 | 253.411 | 6 | ↓ |