In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 11th, 2010 | 15 | Yes |
Popular Name: (3-hydroxy-2-pyridyl)-[(3R)-3-methylpyrrolidin-1-yl]methanone (3-hydroxy-2-pyridyl)-[(3R)-3-me…
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) | 1.20 | 3.85 | -10.8 | 1 | 4 | 0 | 53 | 206.245 | 1 | ↓ |
Hi High (pH 8-9.5) | 1.20 | 3 | -31.3 | 1 | 4 | 0 | 58 | 206.245 | 1 | ↓ |
Mid Mid (pH 6-8) | 1.20 | 4.86 | -54.43 | 0 | 4 | -1 | 56 | 205.237 | 1 | ↓ |
Lo Low (pH 4.5-6) | 1.20 | 2.23 | -36.32 | 2 | 4 | 1 | 55 | 207.253 | 1 | ↓ |