In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 30th, 2009 | 25 | Yes |
Popular Name: (3S)-5-hydroxy-3-[(2S)-2-(pyrrolidin-1-ylmethyl)piperidine-1-carbonyl]indan-1-one (3S)-5-hydroxy-3-[(2S)-2-(pyrrol…
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) | 1.69 | 7.32 | -39.27 | 2 | 5 | 1 | 62 | 343.447 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.69 | 8.09 | -61.2 | 1 | 5 | 0 | 65 | 342.439 | 3 | ↓ |