In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 20 | Yes |
Popular Name: (1S)-N-[[(2R)-1-ethylpyrrolidin-2-yl]methyl]-1-(2-methoxyphenyl)propan-1-amine (1S)-N-[[(2R)-1-ethylpyrrolidin-…
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) | 2.46 | 7.36 | -31.6 | 2 | 3 | 1 | 29 | 277.432 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.46 | 8.51 | -32.23 | 2 | 3 | 1 | 26 | 277.432 | 7 | ↓ |
Lo Low (pH 4.5-6) | 2.46 | 9.23 | -110.31 | 3 | 3 | 2 | 30 | 278.44 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.