In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 17 | Yes |
Popular Name: (2S)-2-amino-N,4-dimethyl-N-[[(2R)-tetrahydropyran-2-yl]methyl]pentanamide (2S)-2-amino-N,4-dimethyl-N-[[(2…
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) | 1.06 | 4.34 | -40.69 | 3 | 4 | 1 | 57 | 243.371 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.06 | 4 | -9.53 | 2 | 4 | 0 | 56 | 242.363 | 5 | ↓ |