In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 4th, 2010 | 20 | Yes |
Popular Name: 5-(3-aminoprop-1-ynyl)-N-methyl-N-(1-methyl-4-piperidyl)thiophene-2-carboxamide 5-(3-aminoprop-1-ynyl)-N-methyl-…
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) | 0.94 | 6.22 | -100.38 | 4 | 4 | 2 | 52 | 293.436 | 2 | ↓ |
Mid Mid (pH 6-8) | 0.94 | 5.82 | -44.06 | 3 | 4 | 1 | 51 | 292.428 | 2 | ↓ |