In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 20 | Yes |
Popular Name: (2S)-N-(4-amino-2-methyl-phenyl)-2-[[(2R)-2-cyanopropyl]-methyl-amino]propanamide (2S)-N-(4-amino-2-methyl-phenyl)…
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) | 1.46 | 5.83 | -48.71 | 4 | 5 | 1 | 83 | 275.376 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.46 | 3.78 | -11.84 | 3 | 5 | 0 | 82 | 274.368 | 5 | ↓ |