In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 21st, 2010 | 17 | Yes |
Popular Name: (3S)-1-cyclopropyl-N-[2-(2-methylimidazol-1-yl)ethyl]pyrrolidin-3-amine (3S)-1-cyclopropyl-N-[2-(2-methy…
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) | 0.38 | 6.96 | -74.07 | 3 | 4 | 2 | 36 | 236.363 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.38 | 6.49 | -38.35 | 2 | 4 | 1 | 34 | 235.355 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.38 | 4.08 | -6.72 | 1 | 4 | 0 | 33 | 234.347 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.38 | 8.16 | -186.73 | 4 | 4 | 3 | 40 | 237.371 | 5 | ↓ |
Lo Low (pH 4.5-6) | 0.38 | 5.74 | -102.16 | 3 | 4 | 2 | 39 | 236.363 | 5 | ↓ |