In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2008 | 21 | Yes |
Popular Name: (3R)-3-pyrrolidin-1-yl-4-(8-quinolyloxy)butan-1-amine (3R)-3-pyrrolidin-1-yl-4-(8-quin…
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) | 1.45 | 3.65 | -48.06 | 3 | 4 | 1 | 53 | 286.399 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.45 | 5.99 | -32.86 | 3 | 4 | 1 | 53 | 286.399 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.45 | 6.06 | -110.16 | 4 | 4 | 2 | 54 | 287.407 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.45 | 6.57 | -188.24 | 5 | 4 | 3 | 55 | 288.415 | 6 | ↓ |