In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 21 | Yes |
Popular Name: (2R,3S)-2-amino-N-(2-dimethylaminoethyl)-3-methyl-N-(3-pyridylmethyl)pentanamide (2R,3S)-2-amino-N-(2-dimethylami…
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) | 0.34 | 6.06 | -115.65 | 4 | 5 | 2 | 65 | 294.443 | 8 | ↓ |
Hi High (pH 8-9.5) | 0.34 | 5.75 | -49.76 | 3 | 5 | 1 | 64 | 293.435 | 8 | ↓ |