In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 15th, 2010 | 17 | Yes |
Popular Name: (2R)-1-[[(1S)-1,3-dimethylbutyl]-methyl-amino]-3-pyrrolidin-1-yl-propan-2-ol (2R)-1-[[(1S)-1,3-dimethylbutyl]…
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) | 2.11 | 4.77 | -32.62 | 2 | 3 | 1 | 28 | 243.415 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.11 | 7.18 | -37.06 | 2 | 3 | 1 | 32 | 243.415 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.11 | 4.12 | -33.23 | 2 | 3 | 1 | 28 | 243.415 | 7 | ↓ |