In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 17 | Yes |
Popular Name: (2S)-1-[[(1R)-cyclohex-3-en-1-yl]methylamino]-3-pyrrolidin-1-yl-propan-2-ol (2S)-1-[[(1R)-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) | 1.34 | 5.6 | -105.68 | 4 | 3 | 2 | 41 | 240.391 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.34 | 6.13 | -42.28 | 3 | 3 | 1 | 44 | 239.383 | 6 | ↓ |