In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 12th, 2009 | 18 | Yes |
Popular Name: (2S)-2-[cyclopentyl(ethyl)amino]-1-piperazin-1-yl-propan-1-one (2S)-2-[cyclopentyl(ethyl)amino]…
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) | 1.10 | 5.12 | -34.29 | 2 | 4 | 1 | 37 | 254.398 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.09 | 4.29 | -5.65 | 1 | 4 | 0 | 36 | 253.39 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.10 | 6.72 | -101.18 | 3 | 4 | 2 | 41 | 255.406 | 4 | ↓ |