In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 21st, 2010 | 19 | Yes |
Popular Name: (2S)-2-[[(3R)-1-cyclopropylpyrrolidin-3-yl]amino]-N-[(1R)-1-methylbutyl]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) | 1.82 | 5.62 | -35.08 | 3 | 4 | 1 | 46 | 268.425 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.82 | 4.45 | -39.15 | 3 | 4 | 1 | 49 | 268.425 | 7 | ↓ |
Lo Low (pH 4.5-6) | 1.82 | 6.79 | -102.04 | 4 | 4 | 2 | 50 | 269.433 | 7 | ↓ |