In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 19 | Yes |
Popular Name: (2R,3R)-2-amino-N-isopropyl-3-methyl-N-(2-pyridylmethyl)pentanamide (2R,3R)-2-amino-N-isopropyl-3-me…
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) | 1.05 | 4.9 | -44.67 | 3 | 4 | 1 | 61 | 264.393 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.05 | 4.57 | -11.34 | 2 | 4 | 0 | 59 | 263.385 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.05 | 5.08 | -89.13 | 4 | 4 | 2 | 62 | 265.401 | 6 | ↓ |