In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 21 | Yes |
Popular Name: N-[2-[(2R)-1-[(2S,3R)-2-amino-3-methyl-pentanoyl]-2-piperidyl]ethyl]methanesulfonamide N-[2-[(2R)-1-[(2S,3R)-2-amino-3-…
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) | 0.48 | 1.02 | -51.12 | 4 | 6 | 1 | 94 | 320.479 | 7 | ↓ |
Hi High (pH 8-9.5) | 0.48 | 0.69 | -15.12 | 3 | 6 | 0 | 93 | 319.471 | 7 | ↓ |