| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 10th, 2010 | 17 | Yes |
Popular Name: (1S,2R)-1-[(3S)-3-methylpyrrolidin-1-yl]-1-(3-methyl-2-thienyl)butan-2-amine (1S,2R)-1-[(3S)-3-methylpyrrolid…
| 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) | 2.82 | 4.87 | -41.69 | 3 | 2 | 1 | 31 | 253.435 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.82 | 4.84 | -2.3 | 2 | 2 | 0 | 29 | 252.427 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.82 | 7.51 | -26.94 | 3 | 2 | 1 | 30 | 253.435 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.82 | 7.23 | -109.1 | 4 | 2 | 2 | 32 | 254.443 | 4 | ↓ |
