In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 21st, 2010 | 17 | Yes |
Popular Name: (2S)-2-[[(3R)-1-cyclopropylpyrrolidin-3-yl]amino]-N-isopropyl-propanamide (2S)-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) | 0.72 | 3.89 | -35.35 | 3 | 4 | 1 | 46 | 240.371 | 5 | ↓ |
Lo Low (pH 4.5-6) | 0.72 | 5.07 | -100.43 | 4 | 4 | 2 | 50 | 241.379 | 5 | ↓ |
Lo Low (pH 4.5-6) | 0.72 | 2.78 | -38.54 | 3 | 4 | 1 | 49 | 240.371 | 5 | ↓ |