In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2010 | 18 | Yes |
Popular Name: (2S)-N1-tert-butyl-N2-cyclopropyl-N2-(2-methoxyethyl)-3-methyl-butane-1,2-diamine (2S)-N1-tert-butyl-N2-cyclopropy…
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) | 2.77 | 6.68 | -30.32 | 2 | 3 | 1 | 29 | 257.442 | 9 | ↓ |
Hi High (pH 8-9.5) | 2.77 | 5.84 | -0.81 | 1 | 3 | 0 | 24 | 256.434 | 9 | ↓ |
Hi High (pH 8-9.5) | 2.77 | 5.88 | -26.03 | 2 | 3 | 1 | 26 | 257.442 | 9 | ↓ |
Mid Mid (pH 6-8) | 2.77 | 7.12 | -98.99 | 3 | 3 | 2 | 30 | 258.45 | 9 | ↓ |