In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 21st, 2010 | 17 | Yes |
Popular Name: (2R)-2-[[(3R)-1-cyclopropylpyrrolidin-3-yl]amino]-N-prop-2-ynyl-propanamide (2R)-2-[[(3R)-1-cyclopropylpyrro…
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) | 0.21 | 3.78 | -37.48 | 3 | 4 | 1 | 46 | 236.339 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.39 | 2.32 | -80.2 | 3 | 4 | 1 | 56 | 236.339 | 5 | ↓ |
Lo Low (pH 4.5-6) | 0.21 | 4.78 | -107.27 | 4 | 4 | 2 | 50 | 237.347 | 5 | ↓ |
Lo Low (pH 4.5-6) | 0.21 | 2.43 | -38.49 | 3 | 4 | 1 | 49 | 236.339 | 5 | ↓ |