| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 21st, 2011 | 18 | Yes |
Popular Name: (1R,2S)-N2-(cyclopropylmethyl)-N2-ethyl-N1-propyl-cycloheptane-1,2-diamine (1R,2S)-N2-(cyclopropylmethyl)-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) | 4.14 | 8.64 | -30.01 | 2 | 2 | 1 | 16 | 253.454 | 7 | ↓ |
| Mid Mid (pH 6-8) | 4.14 | 9.89 | -110.17 | 3 | 2 | 2 | 21 | 254.462 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
