In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 14 | Yes |
Popular Name: (3S)-1-[[(1R)-cyclohex-3-en-1-yl]methyl]-N-methyl-pyrrolidin-3-amine (3S)-1-[[(1R)-cyclohex-3-en-1-yl…
None
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) | 2.05 | 5.62 | -33.95 | 2 | 2 | 1 | 16 | 195.33 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.05 | 3.39 | -0.9 | 1 | 2 | 0 | 15 | 194.322 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.05 | 4.67 | -37.12 | 2 | 2 | 1 | 20 | 195.33 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.05 | 6.88 | -109.99 | 3 | 2 | 2 | 21 | 196.338 | 3 | ↓ |