In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2010 | 17 | Yes |
Popular Name: (2R)-N-[2-(4-cyclopropylpiperazin-1-yl)ethyl]-1-methoxy-propan-2-amine (2R)-N-[2-(4-cyclopropylpiperazi…
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) | 0.70 | 4.11 | -84.95 | 3 | 4 | 2 | 34 | 243.395 | 7 | ↓ |
Hi High (pH 8-9.5) | 0.70 | 0.67 | -2.15 | 1 | 4 | 0 | 28 | 241.379 | 7 | ↓ |
Hi High (pH 8-9.5) | 0.70 | 2.9 | -30.39 | 2 | 4 | 1 | 29 | 242.387 | 7 | ↓ |
Hi High (pH 8-9.5) | 0.70 | 1.9 | -35.77 | 2 | 4 | 1 | 32 | 242.387 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.