In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 19 | Yes |
Popular Name: 2-(cyclopropylmethylamino)-1-(4-isopentylpiperazin-1-yl)ethanone 2-(cyclopropylmethylamino)-1-(4-…
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) | 1.51 | 5.8 | -42.29 | 2 | 4 | 1 | 40 | 268.425 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.51 | 6.65 | -44.26 | 2 | 4 | 1 | 37 | 268.425 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.51 | 4.43 | -6.9 | 1 | 4 | 0 | 36 | 267.417 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.51 | 8.01 | -102.17 | 3 | 4 | 2 | 41 | 269.433 | 7 | ↓ |