In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 13 | Yes |
Popular Name: (2S)-1-[[(2S)-2-hydroxypropyl]amino]-3-isopropoxy-propan-2-ol (2S)-1-[[(2S)-2-hydroxypropyl]am…
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) | -0.44 | -1.69 | -40.82 | 4 | 4 | 1 | 66 | 192.279 | 7 | ↓ |
Hi High (pH 8-9.5) | -0.44 | -3.16 | -6.1 | 3 | 4 | 0 | 62 | 191.271 | 7 | ↓ |