In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 28th, 2004 | 34 | Yes |
Popular Name: 2-furyl-[4-[(2S)-2-hydroxy-3-(methylBLAHyl)propyl]piperazino]methanone 2-furyl-[4-[(2S)-2-hydroxy-3-(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) | 3.06 | 9.11 | -54.53 | 2 | 7 | 1 | 66 | 463.602 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.06 | 9.26 | -56.9 | 2 | 7 | 1 | 66 | 463.602 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.06 | 7 | -15.07 | 1 | 7 | 0 | 65 | 462.594 | 5 | ↓ |