In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 23rd, 2009 | 18 | Yes |
Popular Name: (2R)-N-[(1S)-1-(4-methylthiazol-5-yl)ethyl]-1-(1-piperidyl)propan-2-amine (2R)-N-[(1S)-1-(4-methylthiazol-…
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) | 2.72 | 6.42 | -35.13 | 2 | 3 | 1 | 29 | 268.45 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.72 | 7.5 | -111.36 | 3 | 3 | 2 | 34 | 269.458 | 5 | ↓ |