In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 10th, 2010 | 19 | Yes |
Popular Name: (2R)-1-[(1S)-2-amino-1-(5-chloro-2-thienyl)ethyl]-N-methyl-piperidine-2-carboxamide (2R)-1-[(1S)-2-amino-1-(5-chloro…
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) | 1.43 | 2.01 | -57.16 | 4 | 4 | 1 | 60 | 302.851 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.43 | 1.72 | -8.3 | 3 | 4 | 0 | 58 | 301.843 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.43 | 4.02 | -29.27 | 4 | 4 | 1 | 60 | 302.851 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.43 | 4.39 | -110.07 | 5 | 4 | 2 | 61 | 303.859 | 4 | ↓ |