In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 21st, 2010 | 17 | Yes |
Popular Name: (2S,4R)-1-[(3R)-1-cyclopropylpyrrolidin-3-yl]-N,2-dimethyl-piperidin-4-amine (2S,4R)-1-[(3R)-1-cyclopropylpyr…
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) | 1.36 | 5.38 | -79.95 | 3 | 3 | 2 | 24 | 239.407 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.36 | 2.99 | -37.3 | 2 | 3 | 1 | 23 | 238.399 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.36 | 6.2 | -102.19 | 3 | 3 | 2 | 21 | 239.407 | 3 | ↓ |