In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 20th, 2010 | 17 | Yes |
Popular Name: (3R)-1-cyclopropyl-N-(2-piperazin-1-ylethyl)pyrrolidin-3-amine (3R)-1-cyclopropyl-N-(2-piperazi…
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) | -0.06 | 2.62 | -77.91 | 4 | 4 | 2 | 36 | 240.395 | 5 | ↓ |
Hi High (pH 8-9.5) | -0.06 | 2.41 | -109.2 | 4 | 4 | 2 | 36 | 240.395 | 5 | ↓ |
Hi High (pH 8-9.5) | -0.06 | 0.14 | -38.04 | 3 | 4 | 1 | 35 | 239.387 | 5 | ↓ |
Lo Low (pH 4.5-6) | -0.06 | 3.54 | -80.95 | 4 | 4 | 2 | 33 | 240.395 | 5 | ↓ |
Lo Low (pH 4.5-6) | -0.06 | 4.88 | -172.56 | 5 | 4 | 3 | 38 | 241.403 | 5 | ↓ |