In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 11th, 2008 | 22 | Yes |
Popular Name: (2S,4S)-N-ethyl-1-isopropyl-4-(m-tolylmethylamino)pyrrolidine-2-carboxamide (2S,4S)-N-ethyl-1-isopropyl-4-(m…
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) | 2.21 | 5.66 | -46.58 | 3 | 4 | 1 | 49 | 304.458 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.21 | 4.39 | -6.83 | 2 | 4 | 0 | 44 | 303.45 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.21 | 6.63 | -41.87 | 3 | 4 | 1 | 46 | 304.458 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.21 | 7.81 | -118.66 | 4 | 4 | 2 | 50 | 305.466 | 6 | ↓ |