In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 15 | Yes |
Popular Name: (2S)-1-[[(1S)-cyclohex-3-en-1-yl]methylamino]-3-(dimethylamino)propan-2-ol (2S)-1-[[(1S)-cyclohex-3-en-1-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) | 0.93 | 4.45 | -104.1 | 4 | 3 | 2 | 41 | 214.353 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.93 | 4.99 | -43.46 | 3 | 3 | 1 | 44 | 213.345 | 6 | ↓ |