In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 28th, 2010 | 15 | Yes |
Popular Name: (2S)-2-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]cycloheptanone (2S)-2-[(2R)-2-(hydroxymethyl)py…
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) | 1.18 | 4.04 | -30.06 | 2 | 3 | 1 | 42 | 212.313 | 2 | ↓ |
Hi High (pH 8-9.5) | 1.18 | 2 | -6.62 | 1 | 3 | 0 | 41 | 211.305 | 2 | ↓ |