In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 6th, 2010 | 17 | Yes |
Popular Name: (2S)-1-(4-cyclopentylpiperazin-1-yl)-N-ethyl-propan-2-amine (2S)-1-(4-cyclopentylpiperazin-1…
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) | 2.12 | 6.76 | -88.48 | 3 | 3 | 2 | 24 | 241.423 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.12 | 4.57 | -32.02 | 2 | 3 | 1 | 23 | 240.415 | 5 | ↓ |