In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 19 | Yes |
Popular Name: 3-[(4-isopropylpiperazin-1-yl)methyl]-4-methoxy-aniline 3-[(4-isopropylpiperazin-1-yl)me…
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) | 1.37 | 4.42 | -30.32 | 3 | 4 | 1 | 43 | 264.393 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.37 | 4.47 | -30.34 | 3 | 4 | 1 | 43 | 264.393 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.37 | 2.2 | -4.28 | 2 | 4 | 0 | 42 | 263.385 | 4 | ↓ |