In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2009 | 13 | Yes |
Popular Name: (2R)-1-[[(1R)-1-cyclopropylethyl]-methyl-amino]-3-(methylamino)propan-2-ol (2R)-1-[[(1R)-1-cyclopropylethyl…
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) | 0.68 | 2.99 | -97.17 | 4 | 3 | 2 | 41 | 188.315 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.68 | 1.54 | -31.92 | 3 | 3 | 1 | 37 | 187.307 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.68 | 3.55 | -40.05 | 3 | 3 | 1 | 44 | 187.307 | 6 | ↓ |