In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 27th, 2008 | 22 | Yes |
Popular Name: (2S)-1-(4-benzylpiperazin-1-yl)-3-tert-butoxy-propan-2-ol (2S)-1-(4-benzylpiperazin-1-yl)-…
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) | 2.16 | 5.64 | -40.16 | 2 | 4 | 1 | 37 | 307.458 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.16 | 3.32 | -5.21 | 1 | 4 | 0 | 36 | 306.45 | 7 | ↓ |