In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2009 | 14 | Yes |
Popular Name: (2S)-2-(3-methoxypropylamino)-N-prop-2-ynyl-propanamide (2S)-2-(3-methoxypropylamino)-N-…
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) | -0.05 | 1.67 | -40.56 | 3 | 4 | 1 | 55 | 199.274 | 7 | ↓ |
Hi High (pH 8-9.5) | -0.05 | 0.41 | -7.98 | 2 | 4 | 0 | 50 | 198.266 | 7 | ↓ |
Hi High (pH 8-9.5) | 0.13 | -0.79 | -33.68 | 2 | 4 | 0 | 61 | 198.266 | 7 | ↓ |