In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2008 | 16 | Yes |
Popular Name: 1-[(2R)-1-ethylpyrrolidin-2-yl]-N-[(1-methylpyrrol-2-yl)methyl]methanamine 1-[(2R)-1-ethylpyrrolidin-2-yl]-…
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) | 1.51 | 7.14 | -31.14 | 2 | 3 | 1 | 21 | 222.356 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.51 | 6.09 | -38.42 | 2 | 3 | 1 | 25 | 222.356 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.51 | 8.26 | -116.69 | 3 | 3 | 2 | 26 | 223.364 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.