In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 3rd, 2010 | 14 | Yes |
Popular Name: 2-[methyl-[(3S)-pyrrolidin-3-yl]amino]-N-propyl-acetamide 2-[methyl-[(3S)-pyrrolidin-3-yl]…
None
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) | 0.73 | 2.86 | -108.87 | 4 | 4 | 2 | 50 | 201.314 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.73 | 1.43 | -36.39 | 3 | 4 | 1 | 46 | 200.306 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.73 | -0.76 | -8.11 | 2 | 4 | 0 | 44 | 199.298 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.73 | 0.66 | -43.02 | 3 | 4 | 1 | 49 | 200.306 | 5 | ↓ |