In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2010 | 18 | Yes |
Popular Name: (2S)-N2-cyclopropyl-N2-(2-furylmethyl)-N1-(2-methoxyethyl)propane-1,2-diamine (2S)-N2-cyclopropyl-N2-(2-furylm…
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) | 1.11 | 4.24 | -38.93 | 2 | 4 | 1 | 42 | 253.366 | 9 | ↓ |
Mid Mid (pH 6-8) | 1.11 | 5.04 | -31.99 | 2 | 4 | 1 | 39 | 253.366 | 9 | ↓ |
Mid Mid (pH 6-8) | 1.11 | 6.31 | -107.55 | 3 | 4 | 2 | 43 | 254.374 | 9 | ↓ |
No pre-computed analogs available. Try a structural similarity search.