In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 14 | Yes |
Popular Name: (2R,3R)-N3-(cyclopropylmethyl)-N3-isopropyl-N2-methyl-butane-2,3-diamine (2R,3R)-N3-(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) | 2.33 | 6.69 | -100.28 | 3 | 2 | 2 | 21 | 200.37 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.33 | 5.55 | -27.12 | 2 | 2 | 1 | 16 | 199.362 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.33 | 5.21 | -35.39 | 2 | 2 | 1 | 20 | 199.362 | 6 | ↓ |