In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 19 | Yes |
Popular Name: (1S,2S)-N-methyl-2-[4-(1-piperidyl)-1-piperidyl]cyclopentanamine (1S,2S)-N-methyl-2-[4-(1-piperid…
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) | 2.34 | 5.68 | -30.49 | 2 | 3 | 1 | 20 | 266.453 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.34 | 6.89 | -84.17 | 3 | 3 | 2 | 24 | 267.461 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.34 | 7.87 | -97.07 | 3 | 3 | 2 | 21 | 267.461 | 3 | ↓ |