In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 23rd, 2011 | 14 | Yes |
Popular Name: (1S)-1-cyclopropyl-N-methyl-N-[(5-methylisoxazol-3-yl)methyl]ethanamine (1S)-1-cyclopropyl-N-methyl-N-[(…
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) | 1.89 | 6.68 | -36.23 | 1 | 3 | 1 | 30 | 195.286 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.89 | 4.25 | -6.53 | 0 | 3 | 0 | 29 | 194.278 | 4 | ↓ |