In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 15th, 2011 | 14 | Yes |
Popular Name: (1S)-1-cyclopropyl-N-methyl-2-(4-methylpiperazin-1-yl)ethanamine (1S)-1-cyclopropyl-N-methyl-2-(4…
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) | 0.88 | 4.85 | -86.6 | 3 | 3 | 2 | 24 | 199.342 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.88 | 2.49 | -37.35 | 2 | 3 | 1 | 23 | 198.334 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.