In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 30th, 2010 | 19 | Yes |
Popular Name: (3S,4S)-N3-(cyclopropylmethyl)-N3-isopropyl-chromane-3,4-diamine (3S,4S)-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) | 0.86 | 4.92 | -40.38 | 3 | 3 | 1 | 40 | 261.389 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.86 | 4.79 | -2.58 | 2 | 3 | 0 | 38 | 260.381 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.86 | 6.34 | -33.24 | 3 | 3 | 1 | 40 | 261.389 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.86 | 6.65 | -122.61 | 4 | 3 | 2 | 41 | 262.397 | 4 | ↓ |