In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2009 | 14 | Yes |
Popular Name: (3S)-1-[(2S)-3-amino-2-methyl-propyl]piperidine-3-carboxamide (3S)-1-[(2S)-3-amino-2-methyl-pr…
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) | -0.60 | 0.82 | -103.19 | 6 | 4 | 2 | 75 | 201.314 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.60 | 0.44 | -37.94 | 5 | 4 | 1 | 74 | 200.306 | 4 | ↓ |
Mid Mid (pH 6-8) | -0.60 | -1.14 | -44.49 | 5 | 4 | 1 | 74 | 200.306 | 4 | ↓ |