In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 18 | Yes |
Popular Name: (3S,6R)-1-[(2R)-2-amino-4-methyl-pentanoyl]-6-methyl-piperidine-3-carboxamide (3S,6R)-1-[(2R)-2-amino-4-methyl…
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) | 0.01 | 0.86 | -42.98 | 5 | 5 | 1 | 91 | 256.37 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.01 | 0.57 | -9.16 | 4 | 5 | 0 | 89 | 255.362 | 4 | ↓ |