In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 17 | Yes |
Popular Name: (3R,6S)-1-[(2S)-2-aminopentanoyl]-6-methyl-piperidine-3-carboxamide (3R,6S)-1-[(2S)-2-aminopentanoyl…
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) | -0.20 | 0.7 | -37.46 | 5 | 5 | 1 | 91 | 242.343 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.20 | 0.36 | -14.42 | 4 | 5 | 0 | 89 | 241.335 | 4 | ↓ |